[1-oxidanylidene-1-(phenethylamino)propan-2-yl] 4-(4-chlorophenyl)-4-oxidanylidene-butanoate

Systemtic Name: [1-oxidanylidene-1-(phenethylamino)propan-2-yl] 4-(4-chlorophenyl)-4-oxidanylidene-butanoate Openeye Name: [1-methyl-2-oxo-2-(phenethylamino)ethyl] 4-(4-chlorophenyl)-4-oxo-butanoate CAS Name: 4-(4-chlorophenyl)-4-oxobutanoic acid [1-oxo-1-(phenethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(phenethylamino)propan-2-yl] 4-(4-chlorophenyl)-4-oxobutanoate Traditional Name: 4-(4-chlorophenyl)-4-keto-butyric acid [2-keto-1-methyl-2-(phenethylamino)ethyl] ester Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)CCC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)CCC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H22ClNO4/c1-15(21(26)23-14-13-16-5-3-2-4-6-16)27-20(25)12-11-19(24)17-7-9-18(22)10-8-17/h2-10,15H,11-14H2,1H3,(H,23,26)