N-(1-cyano-4-methyl-cyclohexyl)-N-methyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(1-cyano-4-methyl-cyclohexyl)-N-methyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanamide Openeye Name: N-(1-cyano-4-methyl-cyclohexyl)-N-methyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide CAS Name: N-(1-cyano-4-methylcyclohexyl)-N-methyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide IUPAC Name: N-(1-cyano-4-methylcyclohexyl)-N-methyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide Traditional Name: N-(1-cyano-4-methyl-cyclohexyl)-N-methyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide Formula: C22H30N3O+ MolecularWeight: 352.4931

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C#N)N(C)C(=O)C[NH+]2CCC(=CC2)C3=CC=CC=C3

Isomeric SMILES

CC1CCC(CC1)(C#N)N(C)C(=O)C[NH+]2CCC(=CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O/c1-18-8-12-22(17-23,13-9-18)24(2)21(26)16-25-14-10-20(11-15-25)19-6-4-3-5-7-19/h3-7,10,18H,8-9,11-16H2,1-2H3/p+1