cyanomethyl 1-cyano-3-(3,3-diphenylpropyl)-4-phenyl-piperidine-4-carboxylate hydrochloride

Systemtic Name: cyanomethyl 1-cyano-3-(3,3-diphenylpropyl)-4-phenyl-piperidine-4-carboxylate hydrochloride Openeye Name: cyanomethyl 1-cyano-3-(3,3-diphenylpropyl)-4-phenyl-piperidine-4-carboxylate hydrochloride CAS Name: 1-cyano-3-(3,3-diphenylpropyl)-4-phenyl-4-piperidinecarboxylic acid cyanomethyl ester hydrochloride IUPAC Name: cyanomethyl 1-cyano-3-(3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylate hydrochloride Traditional Name: 1-cyano-3-(3,3-diphenylpropyl)-4-phenyl-isonipecotic acid cyanomethyl ester hydrochloride Formula: C30H30ClN3O2 MolecularWeight: 500.0311

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1(C2=CC=CC=C2)C(=O)OCC#N)CCC(C3=CC=CC=C3)C4=CC=CC=C4)C#N.Cl

Isomeric SMILES

C1CN(CC(C1(C2=CC=CC=C2)C(=O)OCC#N)CCC(C3=CC=CC=C3)C4=CC=CC=C4)C#N.Cl

InChI

InChI=1S/C30H29N3O2.ClH/c31-19-21-35-29(34)30(26-14-8-3-9-15-26)18-20-33(23-32)22-27(30)16-17-28(24-10-4-1-5-11-24)25-12-6-2-7-13-25;/h1-15,27-28H,16-18,20-22H2;1H