decyl-dimethyl-(7-methyloctyl)azanium; 2-decylsulfanylethanamine; chloride

Systemtic Name: decyl-dimethyl-(7-methyloctyl)azanium; 2-decylsulfanylethanamine; chloride Openeye Name: decyl-dimethyl-(7-methyloctyl)ammonium; 2-decylsulfanylethanamine; chloride CAS Name: decyl-dimethyl-(7-methyloctyl)ammonium; 2-(decylthio)ethanamine; chloride IUPAC Name: decyl-dimethyl-(7-methyloctyl)azanium; 2-decylsulfanylethanamine; chloride Traditional Name: decyl-dimethyl-(7-methyloctyl)ammonium; 2-(decylthio)ethylamine; chloride Formula: C33H73ClN2S MolecularWeight: 565.46412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+](C)(C)CCCCCCC(C)C.CCCCCCCCCCSCCN.[Cl-]

Isomeric SMILES

CCCCCCCCCC[N+](C)(C)CCCCCCC(C)C.CCCCCCCCCCSCCN.[Cl-]

InChI

InChI=1S/C21H46N.C12H27NS.ClH/c1-6-7-8-9-10-11-13-16-19-22(4,5)20-17-14-12-15-18-21(2)3;1-2-3-4-5-6-7-8-9-11-14-12-10-13;/h21H,6-20H2,1-5H3;2-13H2,1H3;1H/q+1;;/p-1