4-[[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]-(3-phenylpropyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]-(3-phenylpropyl)amino]methyl]benzenecarbonitrile Openeye Name: 4-[[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-(3-phenylpropyl)amino]methyl]benzonitrile CAS Name: 4-[[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-(3-phenylpropyl)amino]methyl]benzonitrile IUPAC Name: 4-[[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-(3-phenylpropyl)amino]methyl]benzonitrile Traditional Name: 4-[[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-(3-phenylpropyl)amino]methyl]benzonitrile Formula: C30H41N3 MolecularWeight: 443.66664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CC2CCC(CC2)N(CCCC3=CC=CC=C3)CC4=CC=C(C=C4)C#N)N

Isomeric SMILES

C1CC(CCC1CC2CCC(CC2)N(CCCC3=CC=CC=C3)CC4=CC=C(C=C4)C#N)N

InChI

InChI=1S/C30H41N3/c31-22-27-8-10-28(11-9-27)23-33(20-4-7-24-5-2-1-3-6-24)30-18-14-26(15-19-30)21-25-12-16-29(32)17-13-25/h1-3,5-6,8-11,25-26,29-30H,4,7,12-21,23,32H2