pentanoate; trihexyl(methyl)azanium

Systemtic Name: pentanoate; trihexyl(methyl)azanium Openeye Name: pentanoate; trihexyl(methyl)ammonium CAS Name: pentanoate; trihexyl(methyl)ammonium IUPAC Name: pentanoate; trihexyl(methyl)azanium Traditional Name: trihexyl(methyl)ammonium; valerate Formula: C24H51NO2 MolecularWeight: 385.66724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H42N.C5H10O2/c1-5-8-11-14-17-20(4,18-15-12-9-6-2)19-16-13-10-7-3;1-2-3-4-5(6)7/h5-19H2,1-4H3;2-4H2,1H3,(H,6,7)/q+1;/p-1