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3-methylsulfanylpropyl-(phenylmethyl)azanium

3-methylsulfanylpropyl-(phenylmethyl)azanium

Systemtic Name:3-methylsulfanylpropyl-(phenylmethyl)azanium
Openeye Name:benzyl(3-methylsulfanylpropyl)ammonium
CAS Name:3-(methylthio)propyl-(phenylmethyl)ammonium
IUPAC Name:benzyl(3-methylsulfanylpropyl)azanium
Traditional Name:benzyl-[3-(methylthio)propyl]ammonium
Formula: C11H18NS+
MolecularWeight: 196.33232
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Descriptors Computed from Structure

Canonical SMILES:

CSCCC[NH2+]CC1=CC=CC=C1


Isomeric SMILES

CSCCC[NH2+]CC1=CC=CC=C1


InChI

InChI=1S/C11H17NS/c1-13-9-5-8-12-10-11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3/p+1


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