3-[3-[[(4-acetamidophenyl)carbonylhydrazinylidene]methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid

Systemtic Name: 3-[3-[[(4-acetamidophenyl)carbonylhydrazinylidene]methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid Openeye Name: 3-[3-[[(4-acetamidobenzoyl)hydrazono]methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid CAS Name: 3-[3-[[[(4-acetamidophenyl)-oxomethyl]hydrazinylidene]methyl]-2,5-dimethyl-1-pyrrolyl]benzoic acid IUPAC Name: 3-[3-[[(4-acetamidobenzoyl)hydrazinylidene]methyl]-2,5-dimethylpyrrol-1-yl]benzoic acid Traditional Name: 3-[3-[[(4-acetamidobenzoyl)hydrazono]methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC(=C2)C(=O)O)C)C=NNC(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC(=C2)C(=O)O)C)C=NNC(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C23H22N4O4/c1-14-11-19(15(2)27(14)21-6-4-5-18(12-21)23(30)31)13-24-26-22(29)17-7-9-20(10-8-17)25-16(3)28/h4-13H,1-3H3,(H,25,28)(H,26,29)(H,30,31)