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methyl-[(2-nitrophenyl)methyl]-(4-octadecoxyphenyl)sulfanium

methyl-[(2-nitrophenyl)methyl]-(4-octadecoxyphenyl)sulfanium

Systemtic Name:methyl-[(2-nitrophenyl)methyl]-(4-octadecoxyphenyl)sulfanium
Openeye Name:methyl-[(2-nitrophenyl)methyl]-(4-octadecoxyphenyl)sulfonium
CAS Name:methyl-[(2-nitrophenyl)methyl]-(4-octadecoxyphenyl)sulfonium
IUPAC Name:methyl-[(2-nitrophenyl)methyl]-(4-octadecoxyphenyl)sulfanium
Traditional Name:methyl-(2-nitrobenzyl)-(4-stearyloxyphenyl)sulfonium
Formula: C32H50NO3S+
MolecularWeight: 528.8093
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)[S+](C)CC2=CC=CC=C2[N+](=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)[S+](C)CC2=CC=CC=C2[N+](=O)[O-]


InChI

InChI=1S/C32H50NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-27-36-30-23-25-31(26-24-30)37(2)28-29-21-18-19-22-32(29)33(34)35/h18-19,21-26H,3-17,20,27-28H2,1-2H3/q+1


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