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

Systemtic Name: 4-(1,4-dimethylpiperidin-1-ium-1-yl)-2,2-diphenyl-butanamide iodide Openeye Name: 4-(1,4-dimethylpiperidin-1-ium-1-yl)-2,2-diphenyl-butanamide iodide CAS Name: 4-(1,4-dimethyl-1-piperidin-1-iumyl)-2,2-diphenylbutanamide iodide IUPAC Name: 4-(1,4-dimethylpiperidin-1-ium-1-yl)-2,2-diphenylbutanamide iodide Traditional Name: 4-(1,4-dimethylpiperidin-1-ium-1-yl)-2,2-diphenyl-butyramide iodide Formula: C23H31IN2O MolecularWeight: 478.40951

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[N+](CC1)(C)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N.[I-]

Isomeric SMILES

CC1CC[N+](CC1)(C)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N.[I-]

InChI

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