azanium; methyl-bis(prop-2-enyl)-(4-sulfobutyl)azanium; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: azanium; methyl-bis(prop-2-enyl)-(4-sulfobutyl)azanium; 2-(trimethylazaniumyl)ethanoate Openeye Name: ammonium; diallyl-methyl-(4-sulfobutyl)ammonium; 2-(trimethylammonio)acetate CAS Name: ammonium; methyl-bis(prop-2-enyl)-(4-sulfobutyl)ammonium; 2-(trimethylammonio)acetate IUPAC Name: azanium; methyl-bis(prop-2-enyl)-(4-sulfobutyl)azanium; 2-(trimethylazaniumyl)acetate Traditional Name: ammonium; diallyl-methyl-(4-sulfobutyl)ammonium; 2-(trimethylammonio)acetate Formula: C16H37N3O5S+2 MolecularWeight: 383.54708

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(=O)[O-].C[N+](CCCCS(=O)(=O)O)(CC=C)CC=C.[NH4+]

Isomeric SMILES

C[N+](C)(C)CC(=O)[O-].C[N+](CCCCS(=O)(=O)O)(CC=C)CC=C.[NH4+]

InChI

InChI=1S/C11H21NO3S.C5H11NO2.H3N/c1-4-8-12(3,9-5-2)10-6-7-11-16(13,14)15;1-6(2,3)4-5(7)8;/h4-5H,1-2,6-11H2,3H3;4H2,1-3H3;1H3/p+2