ethyl 1-[4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxidanylidene-butanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxidanylidene-butanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxo-butanoyl]piperidine-4-carboxylate CAS Name: 1-[4-[4-(3-chlorophenyl)-1-piperazinyl]-1,4-dioxobutyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxobutanoyl]piperidine-4-carboxylate Traditional Name: 1-[4-[4-(3-chlorophenyl)piperazino]-4-keto-butanoyl]isonipecotic acid ethyl ester Formula: C22H30ClN3O4 MolecularWeight: 435.9443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H30ClN3O4/c1-2-30-22(29)17-8-10-25(11-9-17)20(27)6-7-21(28)26-14-12-24(13-15-26)19-5-3-4-18(23)16-19/h3-5,16-17H,2,6-15H2,1H3