diethyl(4-isothiocyanatobutyl)azanium chloride

Systemtic Name: diethyl(4-isothiocyanatobutyl)azanium chloride Openeye Name: diethyl(4-isothiocyanatobutyl)ammonium chloride CAS Name: diethyl(4-isothiocyanatobutyl)ammonium chloride IUPAC Name: diethyl(4-isothiocyanatobutyl)azanium chloride Traditional Name: diethyl(4-isothiocyanatobutyl)ammonium chloride Formula: C9H19ClN2S MolecularWeight: 222.77856

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCCN=C=S.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCCCN=C=S.[Cl-]

InChI

InChI=1S/C9H18N2S.ClH/c1-3-11(4-2)8-6-5-7-10-9-12;/h3-8H2,1-2H3;1H