ethyl 1-(4-cyano-4,4-diphenyl-butyl)piperidine-4-carboxylate hydrochloride

Systemtic Name: ethyl 1-(4-cyano-4,4-diphenyl-butyl)piperidine-4-carboxylate hydrochloride Openeye Name: ethyl 1-(4-cyano-4,4-diphenyl-butyl)piperidine-4-carboxylate hydrochloride CAS Name: 1-(4-cyano-4,4-diphenylbutyl)-4-piperidinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 1-(4-cyano-4,4-diphenylbutyl)piperidine-4-carboxylate hydrochloride Traditional Name: 1-(4-cyano-4,4-diphenyl-butyl)isonipecotic acid ethyl ester hydrochloride Formula: C25H31ClN2O2 MolecularWeight: 426.97884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CCCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3.Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CCCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3.Cl

InChI

InChI=1S/C25H30N2O2.ClH/c1-2-29-24(28)21-14-18-27(19-15-21)17-9-16-25(20-26,22-10-5-3-6-11-22)23-12-7-4-8-13-23;/h3-8,10-13,21H,2,9,14-19H2,1H3;1H