ethyl 1-[2-[4-(3-chlorophenyl)piperazin-1-yl]propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[4-(3-chlorophenyl)piperazin-1-yl]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[4-(3-chlorophenyl)piperazin-1-yl]propanoyl]piperidine-4-carboxylate CAS Name: 1-[2-[4-(3-chlorophenyl)-1-piperazinyl]-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[4-(3-chlorophenyl)piperazin-1-yl]propanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[4-(3-chlorophenyl)piperazino]propanoyl]isonipecotic acid ethyl ester Formula: C21H30ClN3O3 MolecularWeight: 407.9342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30ClN3O3/c1-3-28-21(27)17-7-9-25(10-8-17)20(26)16(2)23-11-13-24(14-12-23)19-6-4-5-18(22)15-19/h4-6,15-17H,3,7-14H2,1-2H3