1-phenyl-4-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]cyclohexane-1-carbonitrile

Systemtic Name: 1-phenyl-4-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]cyclohexane-1-carbonitrile Openeye Name: 4-[(1-benzylpiperidin-1-ium-4-yl)amino]-1-phenyl-cyclohexanecarbonitrile CAS Name: 1-phenyl-4-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]-1-cyclohexanecarbonitrile IUPAC Name: 4-[(1-benzylpiperidin-1-ium-4-yl)amino]-1-phenylcyclohexane-1-carbonitrile Traditional Name: 4-[(1-benzylpiperidin-1-ium-4-yl)amino]-1-phenyl-cyclohexanecarbonitrile Formula: C25H32N3+ MolecularWeight: 374.54168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2CC[NH+](CC2)CC3=CC=CC=C3)(C#N)C4=CC=CC=C4

Isomeric SMILES

C1CC(CCC1NC2CC[NH+](CC2)CC3=CC=CC=C3)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C25H31N3/c26-20-25(22-9-5-2-6-10-22)15-11-23(12-16-25)27-24-13-17-28(18-14-24)19-21-7-3-1-4-8-21/h1-10,23-24,27H,11-19H2/p+1