3-tert-butyl-9-methyl-9-[3-(1-methylazepan-1-ium-1-yl)propyl]-9-azoniaspiro[5.5]undecane

Systemtic Name: 3-tert-butyl-9-methyl-9-[3-(1-methylazepan-1-ium-1-yl)propyl]-9-azoniaspiro[5.5]undecane Openeye Name: 3-tert-butyl-9-methyl-9-[3-(1-methylazepan-1-ium-1-yl)propyl]-9-azoniaspiro[5.5]undecane CAS Name: 3-tert-butyl-9-methyl-9-[3-(1-methyl-1-azepan-1-iumyl)propyl]-9-azoniaspiro[5.5]undecane IUPAC Name: 3-tert-butyl-9-methyl-9-[3-(1-methylazepan-1-ium-1-yl)propyl]-9-azoniaspiro[5.5]undecane Traditional Name: 3-tert-butyl-9-methyl-9-[3-(1-methylazepan-1-ium-1-yl)propyl]-9-azoniaspiro[5.5]undecane Formula: C25H50N2+2 MolecularWeight: 378.6779

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2(CC1)CC[N+](CC2)(C)CCC[N+]3(CCCCCC3)C

Isomeric SMILES

CC(C)(C)C1CCC2(CC1)CC[N+](CC2)(C)CCC[N+]3(CCCCCC3)C

InChI

InChI=1S/C25H50N2/c1-24(2,3)23-11-13-25(14-12-23)15-21-27(5,22-16-25)20-10-19-26(4)17-8-6-7-9-18-26/h23H,6-22H2,1-5H3/q+2