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(4-isothiocyanatophenyl)methyl-dimethyl-(phenylmethyl)azanium

(4-isothiocyanatophenyl)methyl-dimethyl-(phenylmethyl)azanium

Systemtic Name:(4-isothiocyanatophenyl)methyl-dimethyl-(phenylmethyl)azanium
Openeye Name:benzyl-[(4-isothiocyanatophenyl)methyl]-dimethyl-ammonium
CAS Name:(4-isothiocyanatophenyl)methyl-dimethyl-(phenylmethyl)ammonium
IUPAC Name:benzyl-[(4-isothiocyanatophenyl)methyl]-dimethylazanium
Traditional Name:benzyl-(4-isothiocyanatobenzyl)-dimethyl-ammonium
Formula: C17H19N2S+
MolecularWeight: 283.41116
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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC1=CC=CC=C1)CC2=CC=C(C=C2)N=C=S


Isomeric SMILES

C[N+](C)(CC1=CC=CC=C1)CC2=CC=C(C=C2)N=C=S


InChI

InChI=1S/C17H19N2S/c1-19(2,12-15-6-4-3-5-7-15)13-16-8-10-17(11-9-16)18-14-20/h3-11H,12-13H2,1-2H3/q+1


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