2-methyltridecan-2-yl(thiocyanatomethyl)azanium chloride

Systemtic Name: 2-methyltridecan-2-yl(thiocyanatomethyl)azanium chloride Openeye Name: 1,1-dimethyldodecyl(thiocyanatomethyl)ammonium chloride CAS Name: 2-methyltridecan-2-yl(thiocyanatomethyl)ammonium chloride IUPAC Name: 2-methyltridecan-2-yl(thiocyanatomethyl)azanium chloride Traditional Name: 1,1-dimethyldodecyl(thiocyanatomethyl)ammonium chloride Formula: C16H33ClN2S MolecularWeight: 320.96462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C)(C)[NH2+]CSC#N.[Cl-]

Isomeric SMILES

CCCCCCCCCCCC(C)(C)[NH2+]CSC#N.[Cl-]

InChI

InChI=1S/C16H32N2S.ClH/c1-4-5-6-7-8-9-10-11-12-13-16(2,3)18-15-19-14-17;/h18H,4-13,15H2,1-3H3;1H