4-[1-[4-[(3-cyanophenyl)methoxy]piperidin-1-yl]hexyl]-2-methyl-benzenecarbonitrile

Systemtic Name: 4-[1-[4-[(3-cyanophenyl)methoxy]piperidin-1-yl]hexyl]-2-methyl-benzenecarbonitrile Openeye Name: 4-[1-[4-[(3-cyanophenyl)methoxy]-1-piperidyl]hexyl]-2-methyl-benzonitrile CAS Name: 4-[1-[4-[(3-cyanophenyl)methoxy]-1-piperidinyl]hexyl]-2-methylbenzonitrile IUPAC Name: 4-[1-[4-[(3-cyanophenyl)methoxy]piperidin-1-yl]hexyl]-2-methylbenzonitrile Traditional Name: 4-[1-[4-(3-cyanobenzyl)oxypiperidino]hexyl]-2-methyl-benzonitrile Formula: C27H33N3O MolecularWeight: 415.57042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC(=C(C=C1)C#N)C)N2CCC(CC2)OCC3=CC=CC(=C3)C#N

Isomeric SMILES

CCCCCC(C1=CC(=C(C=C1)C#N)C)N2CCC(CC2)OCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C27H33N3O/c1-3-4-5-9-27(24-10-11-25(19-29)21(2)16-24)30-14-12-26(13-15-30)31-20-23-8-6-7-22(17-23)18-28/h6-8,10-11,16-17,26-27H,3-5,9,12-15,20H2,1-2H3