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Pyrroles
Description:
Compounds containing a pyrrole ring, which is a five-member aromatic heterocycle with one nitrogen atom and four carbon atoms.
Ancestors:
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3-(2，5-Dimethyl-pyrrol-1-yl)-propionic acidCas Number: 134796-54-6 Compound CID: 774196Formula: C9H13NO2 Molecular Weight: 167.21IUPAC Name: 3-(2,5-dimethylpyrrol-1-yl)propanoic acidSMILES: CC1=CC=C(N1CCC(=O)O)CInChIKey: LDSCRIAAKASRHB-UHFFFAOYSA-NInChI: InChI=1S/C9H13NO2/c1-7-3-4-8(2)10(7)6-5-9(11)12/h3-4H,5-6H2,1-2H3,(H,11,12) -
3-(2-FORMYL-1H-PYRROL-1-YL)BENZONITRILECas Number: 209958-45-2 Compound CID: 2779658Formula: C12H8N2O Molecular Weight: 196.2IUPAC Name: 3-(2-formylpyrrol-1-yl)benzonitrileSMILES: C1=CC(=CC(=C1)N2C=CC=C2C=O)C#NInChIKey: VDERABPBRHOLJS-UHFFFAOYSA-NInChI: InChI=1S/C12H8N2O/c13-8-10-3-1-4-11(7-10)14-6-2-5-12(14)9-15/h1-7,9H
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2，3，4-Trimethyl-1H-pyrroleCas Number: 3855-78-5 Compound CID: 572717IUPAC Name: 2,3,4-trimethyl-1H-pyrroleSMILES: CC1=CNC(=C1C)CInChIKey: WTMJHBZSSSDBFQ-UHFFFAOYSA-NInChI: InChI=1S/C7H11N/c1-5-4-8-7(3)6(5)2/h4,8H,1-3H3
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2-PhenylindolizineCas Number: 25379-20-8 Compound CID: 96128Formula: C14H11N Molecular Weight: 193.25IUPAC Name: 2-phenylindolizineSMILES: C1=CC=C(C=C1)C2=CN3C=CC=CC3=C2InChIKey: JMCYJDYOEWQZDE-UHFFFAOYSA-NInChI: InChI=1S/C14H11N/c1-2-6-12(7-3-1)13-10-14-8-4-5-9-15(14)11-13/h1-11H
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2-Phenylindolizine-3-carbaldehydeCas Number: 3672-41-1 Compound CID: 818143Formula: C15H11NO Molecular Weight: 221.25IUPAC Name: 2-phenylindolizine-3-carbaldehydeSMILES: C1=CC=C(C=C1)C2=C(N3C=CC=CC3=C2)C=OInChIKey: HXCCGUNEMZFUFU-UHFFFAOYSA-NInChI: InChI=1S/C15H11NO/c17-11-15-14(12-6-2-1-3-7-12)10-13-8-4-5-9-16(13)15/h1-11H
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2-Phenyl-1H-pyrrolo[2，3-b]pyridineCas Number: 10586-52-4 Compound CID: 606682IUPAC Name: 2-phenyl-1H-pyrrolo[2,3-b]pyridineSMILES: C1=CC=C(C=C1)C2=CC3=C(N2)N=CC=C3InChIKey: PPWLAQVKIFDULF-UHFFFAOYSA-NInChI: InChI=1S/C13H10N2/c1-2-5-10(6-3-1)12-9-11-7-4-8-14-13(11)15-12/h1-9H,(H,14,15)
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2-Methyl-3-(1H-pyrrol-1-yl)benzoic acidCas Number: 83140-96-9 Compound CID: 771129Formula: C12H11NO2 Molecular Weight: 201.23IUPAC Name: 2-methyl-3-pyrrol-1-ylbenzoic acidSMILES: CC1=C(C=CC=C1N2C=CC=C2)C(=O)OInChIKey: TVJDAMBKDKJGKD-UHFFFAOYSA-NInChI: InChI=1S/C12H11NO2/c1-9-10(12(14)15)5-4-6-11(9)13-7-2-3-8-13/h2-8H,1H3,(H,14,15)
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2-Chloro-1-(1-(4-chlorophenyl)-2，5-dimethyl-1H-pyrrol-3-yl)ethanoneCas Number: 571159-05-2 Compound CID: 2060458Formula: C14H13Cl2NOIUPAC Name: 2-chloro-1-[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]ethanoneSMILES: CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)C(=O)CClInChIKey: OYEPFHWXRWTABW-UHFFFAOYSA-NInChI: InChI=1S/C14H13Cl2NO/c1-9-7-13(14(18)8-15)10(2)17(9)12-5-3-11(16)4-6-12/h3-7H,8H2,1-2H3
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2-Amino-4-methyl-1H-pyrrole-3-carbonitrileCas Number: 59146-60-0 Compound CID: 399975Formula: C6H7N3 Molecular Weight: 121.14IUPAC Name: 2-amino-4-methyl-1H-pyrrole-3-carbonitrileSMILES: CC1=CNC(=C1C#N)NInChIKey: QZVGXWVMKIDEID-UHFFFAOYSA-NInChI: InChI=1S/C6H7N3/c1-4-3-9-6(8)5(4)2-7/h3,9H,8H2,1H3
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2-(3，4-Dihydro-2H-Pyrrol-5-Yl)PyrroleCas Number: 10087-65-7 Compound CID: 258381Formula: C8H10N2 Molecular Weight: 134.18IUPAC Name: 2-(3,4-dihydro-2H-pyrrol-5-yl)-1H-pyrroleSMILES: C1CC(=NC1)C2=CC=CN2InChIKey: DTZKPTFBAXPYOT-UHFFFAOYSA-NInChI: InChI=1S/C8H10N2/c1-3-7(9-5-1)8-4-2-6-10-8/h1,3,5,9H,2,4,6H2
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2-(4-(1H-Pyrrol-1-yl)phenyl)acetic acidCas Number: 22048-71-1 Compound CID: 30923Formula: C12H11NO2 Molecular Weight: 201.23IUPAC Name: 2-(4-pyrrol-1-ylphenyl)acetic acidSMILES: C1=CN(C=C1)C2=CC=C(C=C2)CC(=O)OInChIKey: KCZGWRZYJZGMQW-UHFFFAOYSA-NInChI: InChI=1S/C12H11NO2/c14-12(15)9-10-3-5-11(6-4-10)13-7-1-2-8-13/h1-8H,9H2,(H,14,15)
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1H-Pyrrole-2，3-dicarboxylic acidCas Number: 1125-32-2 Compound CID: 150884Formula: C6H5NO4 Molecular Weight: 155.11IUPAC Name: 1H-pyrrole-2,3-dicarboxylic acidSMILES: C1=CNC(=C1C(=O)O)C(=O)OInChIKey: OEUSNWDYXDEXDR-UHFFFAOYSA-NInChI: InChI=1S/C6H5NO4/c8-5(9)3-1-2-7-4(3)6(10)11/h1-2,7H,(H,8,9)(H,10,11)
