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dodecyl-dimethyl-(phenylmethyl)azanium thiocyanate

dodecyl-dimethyl-(phenylmethyl)azanium thiocyanate

Systemtic Name:dodecyl-dimethyl-(phenylmethyl)azanium thiocyanate
Openeye Name:benzyl-dodecyl-dimethyl-ammonium thiocyanate
CAS Name:dodecyl-dimethyl-(phenylmethyl)ammonium thiocyanate
IUPAC Name:benzyl-dodecyl-dimethylazanium thiocyanate
Traditional Name:benzyl-lauryl-dimethyl-ammonium thiocyanate
Formula: C22H38N2S
MolecularWeight: 362.61552
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.C(#N)[S-]


Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.C(#N)[S-]


InChI

InChI=1S/C21H38N.CHNS/c1-4-5-6-7-8-9-10-11-12-16-19-22(2,3)20-21-17-14-13-15-18-21;2-1-3/h13-15,17-18H,4-12,16,19-20H2,1-3H3;3H/q+1;/p-1


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