[1-oxidanylidene-1-(propylamino)propan-2-yl] (2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoate

Systemtic Name: [1-oxidanylidene-1-(propylamino)propan-2-yl] (2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoate Openeye Name: [1-methyl-2-oxo-2-(propylamino)ethyl] (2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(4-methylphenyl)-oxomethyl]amino]butanoic acid [1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propylamino)propan-2-yl] (2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(p-toluoylamino)butyric acid [2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C(C(C)C)NC(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)[C@H](C(C)C)NC(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C19H28N2O4/c1-6-11-20-17(22)14(5)25-19(24)16(12(2)3)21-18(23)15-9-7-13(4)8-10-15/h7-10,12,14,16H,6,11H2,1-5H3,(H,20,22)(H,21,23)/t14?,16-/m0/s1