ethyl 1-[4-(2-pyridin-4-ylpiperazin-1-yl)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-(2-pyridin-4-ylpiperazin-1-yl)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-[2-(4-pyridyl)piperazin-1-yl]benzoyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[4-(2-pyridin-4-yl-1-piperazinyl)phenyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(2-pyridin-4-ylpiperazin-1-yl)benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-[2-(4-pyridyl)piperazino]benzoyl]isonipecotic acid ethyl ester Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)N3CCNCC3C4=CC=NC=C4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)N3CCNCC3C4=CC=NC=C4

InChI

InChI=1S/C24H30N4O3/c1-2-31-24(30)20-9-14-27(15-10-20)23(29)19-3-5-21(6-4-19)28-16-13-26-17-22(28)18-7-11-25-12-8-18/h3-8,11-12,20,22,26H,2,9-10,13-17H2,1H3