methyl 2-[4-(1-azanyl-1-oxidanylidene-propan-2-yl)piperazin-1-yl]-2-(2-chlorophenyl)ethanoate

Systemtic Name: methyl 2-[4-(1-azanyl-1-oxidanylidene-propan-2-yl)piperazin-1-yl]-2-(2-chlorophenyl)ethanoate Openeye Name: methyl 2-[4-(2-amino-1-methyl-2-oxo-ethyl)piperazin-1-yl]-2-(2-chlorophenyl)acetate CAS Name: 2-[4-(1-amino-1-oxopropan-2-yl)-1-piperazinyl]-2-(2-chlorophenyl)acetic acid methyl ester IUPAC Name: methyl 2-[4-(1-amino-1-oxopropan-2-yl)piperazin-1-yl]-2-(2-chlorophenyl)acetate Traditional Name: 2-[4-(2-amino-2-keto-1-methyl-ethyl)piperazino]-2-(2-chlorophenyl)acetic acid methyl ester Formula: C16H22ClN3O3 MolecularWeight: 339.81718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)N1CCN(CC1)C(C2=CC=CC=C2Cl)C(=O)OC

Isomeric SMILES

CC(C(=O)N)N1CCN(CC1)C(C2=CC=CC=C2Cl)C(=O)OC

InChI

InChI=1S/C16H22ClN3O3/c1-11(15(18)21)19-7-9-20(10-8-19)14(16(22)23-2)12-5-3-4-6-13(12)17/h3-6,11,14H,7-10H2,1-2H3,(H2,18,21)