1-[2-methyl-3-(2-methylphenyl)propyl]-1-prop-2-enyl-pyrrolidin-1-ium bromide

Systemtic Name: 1-[2-methyl-3-(2-methylphenyl)propyl]-1-prop-2-enyl-pyrrolidin-1-ium bromide Openeye Name: 1-allyl-1-[2-methyl-3-(o-tolyl)propyl]pyrrolidin-1-ium bromide CAS Name: 1-[2-methyl-3-(2-methylphenyl)propyl]-1-prop-2-enylpyrrolidin-1-ium bromide IUPAC Name: 1-[2-methyl-3-(2-methylphenyl)propyl]-1-prop-2-enylpyrrolidin-1-ium bromide Traditional Name: 1-allyl-1-[2-methyl-3-(o-tolyl)propyl]pyrrolidin-1-ium bromide Formula: C18H28BrN MolecularWeight: 338.32562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(C)C[N+]2(CCCC2)CC=C.[Br-]

Isomeric SMILES

CC1=CC=CC=C1CC(C)C[N+]2(CCCC2)CC=C.[Br-]

InChI

InChI=1S/C18H28N.BrH/c1-4-11-19(12-7-8-13-19)15-16(2)14-18-10-6-5-9-17(18)3;/h4-6,9-10,16H,1,7-8,11-15H2,2-3H3;1H/q+1;/p-1