[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-[(4-methylphenyl)carbonylamino]ethanoate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-[(4-methylphenyl)carbonylamino]ethanoate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 2-[(4-methylbenzoyl)amino]acetate CAS Name: 2-[[(4-methylphenyl)-oxomethyl]amino]acetic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 2-[(4-methylbenzoyl)amino]acetate Traditional Name: 2-(p-toluoylamino)acetic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C16H22N2O4 MolecularWeight: 306.35688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)CNC(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCC(C)NC(=O)COC(=O)CNC(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C16H22N2O4/c1-4-12(3)18-14(19)10-22-15(20)9-17-16(21)13-7-5-11(2)6-8-13/h5-8,12H,4,9-10H2,1-3H3,(H,17,21)(H,18,19)