6-[2-(4-aminocarbonyl-2-methyl-phenyl)-3-(4-methoxyphenyl)pyrrol-1-yl]pyridine-3-carboxylic acid

Systemtic Name: 6-[2-(4-aminocarbonyl-2-methyl-phenyl)-3-(4-methoxyphenyl)pyrrol-1-yl]pyridine-3-carboxylic acid Openeye Name: 6-[2-(4-carbamoyl-2-methyl-phenyl)-3-(4-methoxyphenyl)pyrrol-1-yl]pyridine-3-carboxylic acid CAS Name: 6-[2-(4-carbamoyl-2-methylphenyl)-3-(4-methoxyphenyl)-1-pyrrolyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[2-(4-carbamoyl-2-methylphenyl)-3-(4-methoxyphenyl)pyrrol-1-yl]pyridine-3-carboxylic acid Traditional Name: 6-[2-(4-carbamoyl-2-methyl-phenyl)-3-(4-methoxyphenyl)pyrrol-1-yl]nicotinic acid Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N)C2=C(C=CN2C3=NC=C(C=C3)C(=O)O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N)C2=C(C=CN2C3=NC=C(C=C3)C(=O)O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H21N3O4/c1-15-13-17(24(26)29)5-9-20(15)23-21(16-3-7-19(32-2)8-4-16)11-12-28(23)22-10-6-18(14-27-22)25(30)31/h3-14H,1-2H3,(H2,26,29)(H,30,31)