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Benzoxazinones
Description:
Organic compounds containing a benzene fused to an oxazine ring (a six-member aliphatic ring with four carbon atoms, one oxygen atom, and one nitrogen atom) bearing a ketone group.
Ancestors:
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8-Methyl-2H-benzo[b][1，4]oxazin-3(4H)-oneCas Number: 102065-94-1 Compound CID: 14174152Formula: C9H9NO2 Molecular Weight: 163.17IUPAC Name: 8-methyl-4H-1,4-benzoxazin-3-oneSMILES: CC1=C2C(=CC=C1)NC(=O)CO2InChIKey: SXJYJSYBBLSIPL-UHFFFAOYSA-NInChI: InChI=1S/C9H9NO2/c1-6-3-2-4-7-9(6)12-5-8(11)10-7/h2-4H,5H2,1H3,(H,10,11) -
2，2-Dimethyl-7-nitro-2H-benzo[b][1，4]oxazin-3(4H)-oneCas Number: 85160-83-4 Compound CID: 12793543Formula: C10H10N2O4 Molecular Weight: 222.2IUPAC Name: 2,2-dimethyl-7-nitro-4H-1,4-benzoxazin-3-oneSMILES: CC1(C(=O)NC2=C(O1)C=C(C=C2)[N+](=O)[O-])CInChIKey: KGWYDVZSGRHPFK-UHFFFAOYSA-NInChI: InChI=1S/C10H10N2O4/c1-10(2)9(13)11-7-4-3-6(12(14)15)5-8(7)16-10/h3-5H,1-2H3,(H,11,13)
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2，2-Dimethyl-6-nitro-2H-benzo[b][1，4]oxazin-3(4h)-oneIUPAC Name: 2,2-dimethyl-6-nitro-4H-1,4-benzoxazin-3-oneSMILES: CC1(C(=O)NC2=C(O1)C=CC(=C2)[N+](=O)[O-])CInChIKey: YKXZRZGZJZYBBH-UHFFFAOYSA-NInChI: InChI=1S/C10H10N2O4/c1-10(2)9(13)11-7-5-6(12(14)15)3-4-8(7)16-10/h3-5H,1-2H3,(H,11,13)
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2，2-Dimethyl-4H-1，4-benzoxazin-3-oneCas Number: 10514-70-2 Compound CID: 10607395Formula: 10H11NO2IUPAC Name: 2,2-dimethyl-4H-1,4-benzoxazin-3-oneSMILES: CC1(C(=O)NC2=CC=CC=C2O1)CInChIKey: LJRUKUQEIHJTEL-UHFFFAOYSA-NInChI: InChI=1S/C10H11NO2/c1-10(2)9(12)11-7-5-3-4-6-8(7)13-10/h3-6H,1-2H3,(H,11,12)
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Methyl6-bromo-3-oxo-3，4-dihydro-2H-benzo[b][1，4]oxazine-8-carboxylateCas Number: 141761-85-5 Compound CID: 15665685Formula: C10H8BrNO4 Molecular Weight: 286.09IUPAC Name: methyl 6-bromo-3-oxo-4H-1,4-benzoxazine-8-carboxylateSMILES: COC(=O)C1=C2C(=CC(=C1)Br)NC(=O)CO2InChIKey: FJLFERASKAOESO-UHFFFAOYSA-NInChI: InChI=1S/C10H8BrNO4/c1-15-10(14)6-2-5(11)3-7-9(6)16-4-8(13)12-7/h2-3H,4H2,1H3,(H,12,13)
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Methyl 2-(3-oxo-3，4-dihydro-2H-1，4- benzoxazin-6-yl)acetateCas Number: 866038-49-5 Compound CID: 3785484Formula: C11H11NO4 Molecular Weight: 221.21IUPAC Name: methyl 2-(3-oxo-4H-1,4-benzoxazin-6-yl)acetateSMILES: COC(=O)CC1=CC2=C(C=C1)OCC(=O)N2InChIKey: BSLHZQGTOQQCMK-UHFFFAOYSA-NInChI: InChI=1S/C11H11NO4/c1-15-11(14)5-7-2-3-9-8(4-7)12-10(13)6-16-9/h2-4H,5-6H2,1H3,(H,12,13)
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8-Acetyl-6-benzyloxy-4H-benzo[1，4]oxazin-3-oneCas Number: 869478-09-1 Compound CID: 21100136Formula: C17H15NO4 Molecular Weight: 297.31IUPAC Name: 8-acetyl-6-phenylmethoxy-4H-1,4-benzoxazin-3-oneSMILES: CC(=O)C1=C2C(=CC(=C1)OCC3=CC=CC=C3)NC(=O)CO2InChIKey: URTYAHMRXXVHKS-UHFFFAOYSA-NInChI: InChI=1S/C17H15NO4/c1-11(19)14-7-13(21-9-12-5-3-2-4-6-12)8-15-17(14)22-10-16(20)18-15/h2-8H,9-10H2,1H3,(H,18,20)
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8-Acetyl-5-(benzyloxy)-2H-benzo[b][1，4]oxazin-3(4H)-oneCas Number: 1035229-32-3 Compound CID: 57988970Formula: C17H15NO4 Molecular Weight: 297.31IUPAC Name: 8-acetyl-5-phenylmethoxy-4H-1,4-benzoxazin-3-oneSMILES: CC(=O)C1=C2C(=C(C=C1)OCC3=CC=CC=C3)NC(=O)CO2InChIKey: DKSBVRUAVDKXSO-UHFFFAOYSA-NInChI: InChI=1S/C17H15NO4/c1-11(19)13-7-8-14(16-17(13)22-10-15(20)18-16)21-9-12-5-3-2-4-6-12/h2-8H,9-10H2,1H3,(H,18,20)
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8-(2-Aminoethyl)-5-Hydroxy-2H-Benzo[B][1，4]Oxazin-3(4H)-One HydrochlorideCas Number: 1035229-35-6 Compound CID: 66963355IUPAC Name: 8-(2-aminoethyl)-5-hydroxy-4H-1,4-benzoxazin-3-one;hydrochlorideSMILES: C1C(=O)NC2=C(C=CC(=C2O1)CCN)O.ClInChIKey: YFMULFZNMRCEHG-UHFFFAOYSA-NInChI: InChI=1S/C10H12N2O3.ClH/c11-4-3-6-1-2-7(13)9-10(6)15-5-8(14)12-9;/h1-2,13H,3-5,11H2,(H,12,14);1H
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7-(4，4，5，5-Tetramethyl-1，3，2-dioxaborolan-2-yl)-2H-benzo[b][1，4]oxazin-3(4H)-oneCas Number: 1219130-57-0 Compound CID: 46856482Formula: C14H18BNO4 Molecular Weight: 275.11IUPAC Name: 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4H-1,4-benzoxazin-3-oneSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)NC(=O)CO3InChIKey: SUGHRPQPOYIUBL-UHFFFAOYSA-NInChI: InChI=1S/C14H18BNO4/c1-13(2)14(3,4)20-15(19-13)9-5-6-10-11(7-9)18-8-12(17)16-10/h5-7H,8H2,1-4H3,(H,16,17)
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6-Chloro-4-methyl-3-oxo-3，4-dihydro-2H-benzo[b][1，4]oxazine-8-carboxylic acidCas Number: 123040-79-9 Compound CID: 14771562Formula: C10H8ClNO4 Molecular Weight: 241.63IUPAC Name: 6-chloro-4-methyl-3-oxo-1,4-benzoxazine-8-carboxylic acidSMILES: CN1C(=O)COC2=C(C=C(C=C21)Cl)C(=O)OInChIKey: ZTIKBJABRWRXFK-UHFFFAOYSA-NInChI: InChI=1S/C10H8ClNO4/c1-12-7-3-5(11)2-6(10(14)15)9(7)16-4-8(12)13/h2-3H,4H2,1H3,(H,14,15)
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6-Chloro-3，4-dihydro-3-oxo-2H-1，4-benzoxazine-8-carboxylic acid methyl esterIUPAC Name: methyl 6-chloro-3-oxo-4H-1,4-benzoxazine-8-carboxylateSMILES: COC(=O)C1=C2C(=CC(=C1)Cl)NC(=O)CO2InChIKey: GDSWKMQEDQRHLC-UHFFFAOYSA-NInChI: InChI=1S/C10H8ClNO4/c1-15-10(14)6-2-5(11)3-7-9(6)16-4-8(13)12-7/h2-3H,4H2,1H3,(H,12,13)
