3-(8-aza-5-azoniaspiro[4.5]decan-8-yl)-1-(4-methylphenyl)propan-1-one bromide

Systemtic Name: 3-(8-aza-5-azoniaspiro[4.5]decan-8-yl)-1-(4-methylphenyl)propan-1-one bromide Openeye Name: 3-(8-aza-5-azoniaspiro[4.5]decan-8-yl)-1-(p-tolyl)propan-1-one bromide CAS Name: 3-(8-aza-5-azoniaspiro[4.5]decan-8-yl)-1-(4-methylphenyl)-1-propanone bromide IUPAC Name: 3-(8-aza-5-azoniaspiro[4.5]decan-8-yl)-1-(4-methylphenyl)propan-1-one bromide Traditional Name: 3-(8-aza-5-azoniaspiro[4.5]decan-8-yl)-1-(p-tolyl)propan-1-one bromide Formula: C18H27BrN2O MolecularWeight: 367.32378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCN2CC[N+]3(CCCC3)CC2.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCN2CC[N+]3(CCCC3)CC2.[Br-]

InChI

InChI=1S/C18H27N2O.BrH/c1-16-4-6-17(7-5-16)18(21)8-9-19-10-14-20(15-11-19)12-2-3-13-20;/h4-7H,2-3,8-15H2,1H3;1H/q+1;/p-1