[2-[[2-[(3-methylphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 1H-pyrrole-2-carboxylate

Systemtic Name: [2-[[2-[(3-methylphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 1H-pyrrole-2-carboxylate Openeye Name: [2-[2-(m-tolylcarbamoyl)anilino]-2-oxo-ethyl] 1H-pyrrole-2-carboxylate CAS Name: 1H-pyrrole-2-carboxylic acid [2-[2-[(3-methylanilino)-oxomethyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-[(3-methylphenyl)carbamoyl]anilino]-2-oxoethyl] 1H-pyrrole-2-carboxylate Traditional Name: 1H-pyrrole-2-carboxylic acid [2-keto-2-[2-(m-tolylcarbamoyl)anilino]ethyl] ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=CN3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=CN3

InChI

InChI=1S/C21H19N3O4/c1-14-6-4-7-15(12-14)23-20(26)16-8-2-3-9-17(16)24-19(25)13-28-21(27)18-10-5-11-22-18/h2-12,22H,13H2,1H3,(H,23,26)(H,24,25)