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

Systemtic Name: methyl 2-[4-(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)piperazin-1-yl]-2-(2-chlorophenyl)ethanoate Openeye Name: methyl 2-[4-(2-amino-2-oxo-1-phenyl-ethyl)piperazin-1-yl]-2-(2-chlorophenyl)acetate CAS Name: 2-[4-(2-amino-2-oxo-1-phenylethyl)-1-piperazinyl]-2-(2-chlorophenyl)acetic acid methyl ester IUPAC Name: methyl 2-[4-(2-amino-2-oxo-1-phenylethyl)piperazin-1-yl]-2-(2-chlorophenyl)acetate Traditional Name: 2-[4-(2-amino-2-keto-1-phenyl-ethyl)piperazino]-2-(2-chlorophenyl)acetic acid methyl ester Formula: C21H24ClN3O3 MolecularWeight: 401.88656

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C(C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C21H24ClN3O3/c1-28-21(27)19(16-9-5-6-10-17(16)22)25-13-11-24(12-14-25)18(20(23)26)15-7-3-2-4-8-15/h2-10,18-19H,11-14H2,1H3,(H2,23,26)