(4-butan-2-ylphenyl)methyl-dimethyl-[3-(trimethylazaniumyl)propyl]azanium

Systemtic Name: (4-butan-2-ylphenyl)methyl-dimethyl-[3-(trimethylazaniumyl)propyl]azanium Openeye Name: dimethyl-[(4-sec-butylphenyl)methyl]-[3-(trimethylammonio)propyl]ammonium CAS Name: (4-butan-2-ylphenyl)methyl-dimethyl-[3-(trimethylammonio)propyl]ammonium IUPAC Name: (4-butan-2-ylphenyl)methyl-dimethyl-[3-(trimethylazaniumyl)propyl]azanium Traditional Name: dimethyl-(4-sec-butylbenzyl)-[3-(trimethylammonio)propyl]ammonium Formula: C19H36N2+2 MolecularWeight: 292.50254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C[N+](C)(C)CCC[N+](C)(C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C[N+](C)(C)CCC[N+](C)(C)C

InChI

InChI=1S/C19H36N2/c1-8-17(2)19-12-10-18(11-13-19)16-21(6,7)15-9-14-20(3,4)5/h10-13,17H,8-9,14-16H2,1-7H3/q+2