2-methylpropanoate; trihexyl(methyl)azanium

Systemtic Name: 2-methylpropanoate; trihexyl(methyl)azanium Openeye Name: 2-methylpropanoate; trihexyl(methyl)ammonium CAS Name: 2-methylpropanoate; trihexyl(methyl)ammonium IUPAC Name: 2-methylpropanoate; trihexyl(methyl)azanium Traditional Name: trihexyl(methyl)ammonium isobutyrate Formula: C23H49NO2 MolecularWeight: 371.64066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H42N.C4H8O2/c1-5-8-11-14-17-20(4,18-15-12-9-6-2)19-16-13-10-7-3;1-3(2)4(5)6/h5-19H2,1-4H3;3H,1-2H3,(H,5,6)/q+1;/p-1