ethyl 1-[3-oxidanylidene-3-(4-phenylmethoxyphenyl)propyl]piperidine-4-carboxylate hydrochloride

Systemtic Name: ethyl 1-[3-oxidanylidene-3-(4-phenylmethoxyphenyl)propyl]piperidine-4-carboxylate hydrochloride Openeye Name: ethyl 1-[3-(4-benzyloxyphenyl)-3-oxo-propyl]piperidine-4-carboxylate hydrochloride CAS Name: 1-[3-oxo-3-(4-phenylmethoxyphenyl)propyl]-4-piperidinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 1-[3-oxo-3-(4-phenylmethoxyphenyl)propyl]piperidine-4-carboxylate hydrochloride Traditional Name: 1-[3-(4-benzoxyphenyl)-3-keto-propyl]isonipecotic acid ethyl ester hydrochloride Formula: C24H30ClNO4 MolecularWeight: 431.9523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CCC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3.Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CCC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3.Cl

InChI

InChI=1S/C24H29NO4.ClH/c1-2-28-24(27)21-12-15-25(16-13-21)17-14-23(26)20-8-10-22(11-9-20)29-18-19-6-4-3-5-7-19;/h3-11,21H,2,12-18H2,1H3;1H