2-cyanoethyl 1-(3-azanylpropyl)-4-phenyl-piperidine-4-carboxylate hydrochloride

Systemtic Name: 2-cyanoethyl 1-(3-azanylpropyl)-4-phenyl-piperidine-4-carboxylate hydrochloride Openeye Name: 2-cyanoethyl 1-(3-aminopropyl)-4-phenyl-piperidine-4-carboxylate hydrochloride CAS Name: 1-(3-aminopropyl)-4-phenyl-4-piperidinecarboxylic acid 2-cyanoethyl ester hydrochloride IUPAC Name: 2-cyanoethyl 1-(3-aminopropyl)-4-phenylpiperidine-4-carboxylate hydrochloride Traditional Name: 1-(3-aminopropyl)-4-phenyl-isonipecotic acid 2-cyanoethyl ester hydrochloride Formula: C18H26ClN3O2 MolecularWeight: 351.87094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)OCCC#N)CCCN.Cl

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)OCCC#N)CCCN.Cl

InChI

InChI=1S/C18H25N3O2.ClH/c19-10-4-12-21-13-8-18(9-14-21,16-6-2-1-3-7-16)17(22)23-15-5-11-20;/h1-3,6-7H,4-5,8-10,12-15,19H2;1H