(4-cyano-4-phenyl-cyclohexyl)-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: (4-cyano-4-phenyl-cyclohexyl)-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-(4-cyano-4-phenyl-cyclohexyl)ammonium CAS Name: (4-cyano-4-phenylcyclohexyl)-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-(4-cyano-4-phenylcyclohexyl)azanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-(4-cyano-4-phenyl-cyclohexyl)ammonium Formula: C25H33N3+2 MolecularWeight: 375.54962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1[NH2+]C2CC[NH+](CC2)CC3=CC=CC=C3)(C#N)C4=CC=CC=C4

Isomeric SMILES

C1CC(CCC1[NH2+]C2CC[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+2