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(2,6-dinitrophenyl)methyl (4-methylphenyl) sulfite

(2,6-dinitrophenyl)methyl (4-methylphenyl) sulfite

Systemtic Name:(2,6-dinitrophenyl)methyl (4-methylphenyl) sulfite
Openeye Name:(2,6-dinitrophenyl)methyl p-tolyl sulfite
CAS Name:sulfurous acid (2,6-dinitrophenyl)methyl (4-methylphenyl) ester
IUPAC Name:(2,6-dinitrophenyl)methyl (4-methylphenyl) sulfite
Traditional Name:sulfurous acid (2,6-dinitrobenzyl) p-tolyl ester
Formula: C14H12N2O7S
MolecularWeight: 352.31928
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)OCC2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)OCC2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C14H12N2O7S/c1-10-5-7-11(8-6-10)23-24(21)22-9-12-13(15(17)18)3-2-4-14(12)16(19)20/h2-8H,9H2,1H3


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