[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-methyl-2-[(2-methylbenzoyl)amino]butanoate CAS Name: 3-methyl-2-[[(2-methylphenyl)-oxomethyl]amino]butanoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-methyl-2-[(2-methylbenzoyl)amino]butanoate Traditional Name: 3-methyl-2-(o-toluoylamino)butyric acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)OCC(=O)C2=CC=CN2

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)OCC(=O)C2=CC=CN2

InChI

InChI=1S/C19H22N2O4/c1-12(2)17(21-18(23)14-8-5-4-7-13(14)3)19(24)25-11-16(22)15-9-6-10-20-15/h4-10,12,17,20H,11H2,1-3H3,(H,21,23)