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4-methylbenzenesulfonate; methyl-nonyl-(phenylmethylidene)azanium

4-methylbenzenesulfonate; methyl-nonyl-(phenylmethylidene)azanium

Systemtic Name:4-methylbenzenesulfonate; methyl-nonyl-(phenylmethylidene)azanium
Openeye Name:benzylidene-methyl-nonyl-ammonium; 4-methylbenzenesulfonate
CAS Name:4-methylbenzenesulfonate; methyl-nonyl-(phenylmethylene)ammonium
IUPAC Name:benzylidene-methyl-nonylazanium; 4-methylbenzenesulfonate
Traditional Name:benzal-methyl-nonyl-ammonium tosylate
Formula: C24H35NO3S
MolecularWeight: 417.6046
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C17H28N.C7H8O3S/c1-3-4-5-6-7-8-12-15-18(2)16-17-13-10-9-11-14-17;1-6-2-4-7(5-3-6)11(8,9)10/h9-11,13-14,16H,3-8,12,15H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1


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