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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)OCC#N)CCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)OCC#N)CCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

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