butanoate; trimethyl(2-sulfanylethyl)azanium; hydrochloride

Systemtic Name: butanoate; trimethyl(2-sulfanylethyl)azanium; hydrochloride Openeye Name: butanoate; trimethyl(2-sulfanylethyl)ammonium; hydrochloride CAS Name: butanoate; 2-mercaptoethyl(trimethyl)ammonium; hydrochloride IUPAC Name: butanoate; trimethyl(2-sulfanylethyl)azanium; hydrochloride Traditional Name: butyrate; 2-mercaptoethyl(trimethyl)ammonium; hydrochloride Formula: C9H22ClNO2S MolecularWeight: 243.79448

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)[O-].C[N+](C)(C)CCS.Cl

Isomeric SMILES

CCCC(=O)[O-].C[N+](C)(C)CCS.Cl

InChI

InChI=1S/C5H13NS.C4H8O2.ClH/c1-6(2,3)4-5-7;1-2-3-4(5)6;/h4-5H2,1-3H3;2-3H2,1H3,(H,5,6);1H