[1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 3-acetamido-3-(4-chlorophenyl)propanoate

Systemtic Name: [1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 3-acetamido-3-(4-chlorophenyl)propanoate Openeye Name: [2-(benzylamino)-1-methyl-2-oxo-ethyl] 3-acetamido-3-(4-chlorophenyl)propanoate CAS Name: 3-acetamido-3-(4-chlorophenyl)propanoic acid [1-oxo-1-[(phenylmethyl)amino]propan-2-yl] ester IUPAC Name: [1-(benzylamino)-1-oxopropan-2-yl] 3-acetamido-3-(4-chlorophenyl)propanoate Traditional Name: 3-acetamido-3-(4-chlorophenyl)propionic acid [2-(benzylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)OC(=O)CC(C2=CC=C(C=C2)Cl)NC(=O)C

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)OC(=O)CC(C2=CC=C(C=C2)Cl)NC(=O)C

InChI

InChI=1S/C21H23ClN2O4/c1-14(21(27)23-13-16-6-4-3-5-7-16)28-20(26)12-19(24-15(2)25)17-8-10-18(22)11-9-17/h3-11,14,19H,12-13H2,1-2H3,(H,23,27)(H,24,25)