3-[[1-(4-cyano-5-methyl-4-phenyl-hexyl)piperidin-4-yl]oxymethyl]benzenecarbonitrile

Systemtic Name: 3-[[1-(4-cyano-5-methyl-4-phenyl-hexyl)piperidin-4-yl]oxymethyl]benzenecarbonitrile Openeye Name: 3-[[1-(4-cyano-5-methyl-4-phenyl-hexyl)-4-piperidyl]oxymethyl]benzonitrile CAS Name: 3-[[1-(4-cyano-5-methyl-4-phenylhexyl)-4-piperidinyl]oxymethyl]benzonitrile IUPAC Name: 3-[[1-(4-cyano-5-methyl-4-phenylhexyl)piperidin-4-yl]oxymethyl]benzonitrile Traditional Name: 3-[[1-(4-cyano-5-methyl-4-phenyl-hexyl)-4-piperidyl]oxymethyl]benzonitrile Formula: C27H33N3O MolecularWeight: 415.57042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCC(CC1)OCC2=CC=CC(=C2)C#N)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCCN1CCC(CC1)OCC2=CC=CC(=C2)C#N)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C27H33N3O/c1-22(2)27(21-29,25-10-4-3-5-11-25)14-7-15-30-16-12-26(13-17-30)31-20-24-9-6-8-23(18-24)19-28/h3-6,8-11,18,22,26H,7,12-17,20H2,1-2H3