4-methylbenzenesulfonic acid; trimethyl-[2-(trimethylazaniumyl)ethyl]azanium

Systemtic Name: 4-methylbenzenesulfonic acid; trimethyl-[2-(trimethylazaniumyl)ethyl]azanium Openeye Name: 4-methylbenzenesulfonic acid; trimethyl-[2-(trimethylammonio)ethyl]ammonium CAS Name: 4-methylbenzenesulfonic acid; trimethyl-[2-(trimethylammonio)ethyl]ammonium IUPAC Name: 4-methylbenzenesulfonic acid; trimethyl-[2-(trimethylazaniumyl)ethyl]azanium Traditional Name: tosylic acid; trimethyl-[2-(trimethylammonio)ethyl]ammonium Formula: C15H30N2O3S+2 MolecularWeight: 318.4753

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C[N+](C)(C)CC[N+](C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C[N+](C)(C)CC[N+](C)(C)C

InChI

InChI=1S/C8H22N2.C7H8O3S/c1-9(2,3)7-8-10(4,5)6;1-6-2-4-7(5-3-6)11(8,9)10/h7-8H2,1-6H3;2-5H,1H3,(H,8,9,10)/q+2;