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methyl-nonyl-(phenylmethyl)sulfanium; propane-1-sulfonate

methyl-nonyl-(phenylmethyl)sulfanium; propane-1-sulfonate

Systemtic Name:methyl-nonyl-(phenylmethyl)sulfanium; propane-1-sulfonate
Openeye Name:benzyl-methyl-nonyl-sulfonium; propane-1-sulfonate
CAS Name:methyl-nonyl-(phenylmethyl)sulfonium; 1-propanesulfonate
IUPAC Name:benzyl-methyl-nonylsulfanium; propane-1-sulfonate
Traditional Name:benzyl-methyl-nonyl-sulfonium; propane-1-sulfonate
Formula: C20H36O3S2
MolecularWeight: 388.62804
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC[S+](C)CC1=CC=CC=C1.CCCS(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCC[S+](C)CC1=CC=CC=C1.CCCS(=O)(=O)[O-]


InChI

InChI=1S/C17H29S.C3H8O3S/c1-3-4-5-6-7-8-12-15-18(2)16-17-13-10-9-11-14-17;1-2-3-7(4,5)6/h9-11,13-14H,3-8,12,15-16H2,1-2H3;2-3H2,1H3,(H,4,5,6)/q+1;/p-1


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