(2S,4S,6R)-2-(4-cyanobutyl)-4-methyl-6-pentyl-1-phenyl-piperidine-2-carbonitrile

Systemtic Name: (2S,4S,6R)-2-(4-cyanobutyl)-4-methyl-6-pentyl-1-phenyl-piperidine-2-carbonitrile Openeye Name: (2S,4S,6R)-2-(4-cyanobutyl)-4-methyl-6-pentyl-1-phenyl-piperidine-2-carbonitrile CAS Name: (2S,4S,6R)-2-(4-cyanobutyl)-4-methyl-6-pentyl-1-phenyl-2-piperidinecarbonitrile IUPAC Name: (2S,4S,6R)-2-(4-cyanobutyl)-4-methyl-6-pentyl-1-phenylpiperidine-2-carbonitrile Traditional Name: (2S,4S,6R)-6-amyl-2-(4-cyanobutyl)-4-methyl-1-phenyl-pipecolinonitrile Formula: C23H33N3 MolecularWeight: 351.52822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC(CC(N1C2=CC=CC=C2)(CCCCC#N)C#N)C

Isomeric SMILES

CCCCC[C@@H]1C[C@@H](C[C@@](N1C2=CC=CC=C2)(CCCCC#N)C#N)C

InChI

InChI=1S/C23H33N3/c1-3-4-7-14-22-17-20(2)18-23(19-25,15-10-6-11-16-24)26(22)21-12-8-5-9-13-21/h5,8-9,12-13,20,22H,3-4,6-7,10-11,14-15,17-18H2,1-2H3/t20-,22+,23-/m0/s1