4-(1,2-dimethylpiperidin-1-ium-1-yl)-2,2-diphenyl-butanamide bromide

Systemtic Name: 4-(1,2-dimethylpiperidin-1-ium-1-yl)-2,2-diphenyl-butanamide bromide Openeye Name: 4-(1,2-dimethylpiperidin-1-ium-1-yl)-2,2-diphenyl-butanamide bromide CAS Name: 4-(1,2-dimethyl-1-piperidin-1-iumyl)-2,2-diphenylbutanamide bromide IUPAC Name: 4-(1,2-dimethylpiperidin-1-ium-1-yl)-2,2-diphenylbutanamide bromide Traditional Name: 4-(1,2-dimethylpiperidin-1-ium-1-yl)-2,2-diphenyl-butyramide bromide Formula: C23H31BrN2O MolecularWeight: 431.40904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[N+]1(C)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N.[Br-]

Isomeric SMILES

CC1CCCC[N+]1(C)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N.[Br-]

InChI

InChI=1S/C23H30N2O.BrH/c1-19-11-9-10-17-25(19,2)18-16-23(22(24)26,20-12-5-3-6-13-20)21-14-7-4-8-15-21;/h3-8,12-15,19H,9-11,16-18H2,1-2H3,(H-,24,26);1H