ethyl 2-(4-chlorophenyl)-2-[4-[(6-oxidanylidene-1H-pyridin-3-yl)carbonyl]piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-(4-chlorophenyl)-2-[4-[(6-oxidanylidene-1H-pyridin-3-yl)carbonyl]piperazin-1-yl]ethanoate Openeye Name: ethyl 2-(4-chlorophenyl)-2-[4-(6-oxo-1H-pyridine-3-carbonyl)piperazin-1-yl]acetate CAS Name: 2-(4-chlorophenyl)-2-[4-[oxo-(6-oxo-1H-pyridin-3-yl)methyl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(4-chlorophenyl)-2-[4-(6-oxo-1H-pyridine-3-carbonyl)piperazin-1-yl]acetate Traditional Name: 2-(4-chlorophenyl)-2-[4-(6-keto-1H-pyridine-3-carbonyl)piperazino]acetic acid ethyl ester Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CNC(=O)C=C3

Isomeric SMILES

CCOC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CNC(=O)C=C3

InChI

InChI=1S/C20H22ClN3O4/c1-2-28-20(27)18(14-3-6-16(21)7-4-14)23-9-11-24(12-10-23)19(26)15-5-8-17(25)22-13-15/h3-8,13,18H,2,9-12H2,1H3,(H,22,25)