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Benzofuranones
Description:
Organic compounds containing a benzene ring fused to a furanone.
Ancestors:
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o-Phthalic anhydrideCas Number: 85-44-9 EC Number: 201-607-5Formula: C8H4O3 Molecular Weight: 148.12IUPAC Name: 2-benzofuran-1,3-dioneSMILES: C1=CC=C2C(=C1)C(=O)OC2=OInChIKey: LGRFSURHDFAFJT-UHFFFAOYSA-NInChI: InChI=1S/C8H4O3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h1-4H
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phthalophenoneCas Number: 596-29-2Formula: C20H14O2 Molecular Weight: 286.324SMILES: C1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=CC=CC=C4InChIKey: WUBNJKMFYXGQDB-UHFFFAOYSA-NInChI: InChI=1S/C20H14O2/c21-19-17-13-7-8-14-18(17)20(22-19,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H
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3,4,5,6-TetrabromophenolsulfonephthaleinCas Number: 77172-72-6 Compound CID: 564972Formula: C19H10Br4O5S Molecular Weight: 669.96IUPAC Name: 4-[4,5,6,7-tetrabromo-3-(4-hydroxyphenyl)-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]phenolSMILES: C1=CC(=CC=C1C2(C3=C(C(=C(C(=C3Br)Br)Br)Br)S(=O)(=O)O2)C4=CC=C(C=C4)O)OInChIKey: ARVZQGSXIKSAAY-UHFFFAOYSA-NInChI: InChI=1S/C19H10Br4O5S/c20-14-13-18(17(23)16(22)15(14)21)29(26,27)28-19(13,9-1-5-11(24)6-2-9)10-3-7-12(25)8-4-10/h1-8,24-25H
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3,6-Difluorophthalic AnhydrideCas Number: 652-40-4 Compound CID: 513918Formula: C8H2F2O3 Molecular Weight: 184.1IUPAC Name: 4,7-difluoro-2-benzofuran-1,3-dioneSMILES: Fc1ccc(F)c2C(=O)OC(=O)c12InChIKey: AVLRPSLTCCWJKC-UHFFFAOYSA-NInChI: InChI=1S/C8H2F2O3/c9-3-1-2-4(10)6-5(3)7(11)13-8(6)12/h1-2H
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5,5'-(1,4-Phenylenebis(oxy))bis(isobenzofuran-1,3-dione)Cas Number: 17828-53-4 Compound CID: 14549436Formula: C22H10O8 Molecular Weight: 402.3IUPAC Name: 5-[4-[(1,3-dioxo-2-benzofuran-5-yl)oxy]phenoxy]-2-benzofuran-1,3-dioneSMILES: C1=CC(=CC=C1OC2=CC3=C(C=C2)C(=O)OC3=O)OC4=CC5=C(C=C4)C(=O)OC5=OInChIKey: BBTGUNMUUYNPLH-UHFFFAOYSA-NInChI: InChI=1S/C22H10O8/c23-19-15-7-5-13(9-17(15)21(25)29-19)27-11-1-2-12(4-3-11)28-14-6-8-16-18(10-14)22(26)30-20(16)24/h1-10H
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5,6-Bis((4-methoxybenzyl)oxy)isobenzofuran-1,3-dioneCas Number: 1609071-04-6Formula: C24H20O7 Molecular Weight: 420.41SMILES: COC1=CC=C(C=C1)COC2=C(C=C3C(=C2)C(=O)OC3=O)OCC4=CC=C(C=C4)OCInChIKey: BLMQFZDSZGKYFR-UHFFFAOYSA-NInChI: InChI=1S/C24H20O7/c1-27-17-7-3-15(4-8-17)13-29-21-11-19-20(24(26)31-23(19)25)12-22(21)30-14-16-5-9-18(28-2)10-6-16/h3-12H,13-14H2,1-2H3
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5-CHLORO-3H-SPIRO[ISOBENZOFURAN-1,4'-PIPERIDIN]-3-ONE HCLCas Number: 180160-47-8 Compound CID: 23136949Formula: C12H12ClNO2 Molecular Weight: 237.68IUPAC Name: 6-chlorospiro[2-benzofuran-3,4'-piperidine]-1-oneSMILES: C1CNCCC12C3=C(C=C(C=C3)Cl)C(=O)O2InChIKey: SIUBZWCKBKOZMD-UHFFFAOYSA-NInChI: InChI=1S/C12H12ClNO2/c13-8-1-2-10-9(7-8)11(15)16-12(10)3-5-14-6-4-12/h1-2,7,14H,3-6H2
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4,5,6,7-Tetraiodoisobenzofuran-1,3-dioneCas Number: 632-80-4Formula: C8I4O3 Molecular Weight: 651.70IUPAC Name: 4,5,6,7-tetraiodo-2-benzofuran-1,3-dioneSMILES: C12=C(C(=C(C(=C1I)I)I)I)C(=O)OC2=OInChIKey: UHIMKEGZFOQVHV-UHFFFAOYSA-NInChI: InChI=1S/C8I4O3/c9-3-1-2(8(14)15-7(1)13)4(10)6(12)5(3)11
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4-Aminoisobenzofuran-1,3-dioneCas Number: 17395-99-2 Compound CID: 345551Formula: C8H5NO3 Molecular Weight: 163.13IUPAC Name: 4-amino-2-benzofuran-1,3-dioneSMILES: C1=CC2=C(C(=C1)N)C(=O)OC2=OInChIKey: DQNFPCOVVBRXOY-UHFFFAOYSA-NInChI: InChI=1S/C8H5NO3/c9-5-3-1-2-4-6(5)8(11)12-7(4)10/h1-3H,9H2
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3,3-Bis(1-butyl-2-methyl-1H-indol-3-yl)isobenzofuran-1(3H)-oneCas Number: 50292-91-6 Compound CID: 162583Formula: C34H36N2O2 Molecular Weight: 504.68IUPAC Name: 3,3-bis(1-butyl-2-methylindol-3-yl)-2-benzofuran-1-oneSMILES: CCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(N(C6=CC=CC=C65)CCCC)C)CInChIKey: JZEPXWWZAJGALH-UHFFFAOYSA-NInChI: show more
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4,7-Dichloro-1,3-dioxo-1,3-dihydroisobenzofuran-5-carboxylic acidCas Number: 81742-10-1 EC Number: 862-993-4Formula: C9H2O5Cl2 Molecular Weight: 261.02IUPAC Name: 4,7-dichloro-1,3-dioxo-2-benzofuran-5-carboxylic acidSMILES: C1=C(C(=C2C(=C1Cl)C(=O)OC2=O)Cl)C(=O)OInChIKey: OCUQMPDZMXSVFG-UHFFFAOYSA-NInChI: InChI=1S/C9H2Cl2O5/c10-3-1-2(7(12)13)6(11)5-4(3)8(14)16-9(5)15/h1H,(H,12,13)
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HPK1-IN-7Cas Number: 2320462-65-3 Compound CID: 142587219Formula: C24H22N6O4 Molecular Weight: 458.5IUPAC Name: 5-[[4-[[(1S)-2-hydroxy-1-phenylethyl]amino]-5-(1,3,4-oxadiazol-2-yl)pyrimidin-2-yl]amino]-3,3-dimethyl-2-benzofuran-1-oneSMILES: CC1(C2=C(C=CC(=C2)NC3=NC=C(C(=N3)NC(CO)C4=CC=CC=C4)C5=NN=CO5)C(=O)O1)CInChIKey: RVSSNRBUPQUIEG-LJQANCHMSA-NInChI: show more


