[1-[(4-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-benzamidobutanoate

Systemtic Name: [1-[(4-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-benzamidobutanoate Openeye Name: [2-[(4-chlorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-benzamidobutanoate CAS Name: 3-benzamidobutanoic acid [1-[(4-chlorophenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-chlorophenyl)methylamino]-1-oxopropan-2-yl] 3-benzamidobutanoate Traditional Name: 3-benzamidobutyric acid [2-[(4-chlorobenzyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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