4-[[[1-(3-methylphenyl)-2-oxidanylidene-pyridin-3-yl]carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[[1-(3-methylphenyl)-2-oxidanylidene-pyridin-3-yl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[[1-(m-tolyl)-2-oxo-pyridine-3-carbonyl]amino]methyl]benzoic acid CAS Name: 4-[[[[1-(3-methylphenyl)-2-oxo-3-pyridinyl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[1-(3-methylphenyl)-2-oxopyridine-3-carbonyl]amino]methyl]benzoic acid Traditional Name: 4-[[[2-keto-1-(m-tolyl)nicotinoyl]amino]methyl]benzoic acid Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CC=C(C2=O)C(=O)NCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CC=C(C2=O)C(=O)NCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H18N2O4/c1-14-4-2-5-17(12-14)23-11-3-6-18(20(23)25)19(24)22-13-15-7-9-16(10-8-15)21(26)27/h2-12H,13H2,1H3,(H,22,24)(H,26,27)