5-[3-ethanoyl-2-methyl-5-(4-methylphenyl)pyrrol-1-yl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[3-ethanoyl-2-methyl-5-(4-methylphenyl)pyrrol-1-yl]-2-oxidanyl-benzoic acid Openeye Name: 5-[3-acetyl-2-methyl-5-(p-tolyl)pyrrol-1-yl]-2-hydroxy-benzoic acid CAS Name: 5-[3-acetyl-2-methyl-5-(4-methylphenyl)-1-pyrrolyl]-2-hydroxybenzoic acid IUPAC Name: 5-[3-acetyl-2-methyl-5-(4-methylphenyl)pyrrol-1-yl]-2-hydroxybenzoic acid Traditional Name: 5-[3-acetyl-2-methyl-5-(p-tolyl)pyrrol-1-yl]-2-hydroxy-benzoic acid Formula: C21H19NO4 MolecularWeight: 349.37986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(N2C3=CC(=C(C=C3)O)C(=O)O)C)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(N2C3=CC(=C(C=C3)O)C(=O)O)C)C(=O)C

InChI

InChI=1S/C21H19NO4/c1-12-4-6-15(7-5-12)19-11-17(14(3)23)13(2)22(19)16-8-9-20(24)18(10-16)21(25)26/h4-11,24H,1-3H3,(H,25,26)