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2-nitro-3,4-bis(oxidanyl)-6-(phenylsulfonyl)benzenecarbonitrile

2-nitro-3,4-bis(oxidanyl)-6-(phenylsulfonyl)benzenecarbonitrile

Systemtic Name:2-nitro-3,4-bis(oxidanyl)-6-(phenylsulfonyl)benzenecarbonitrile
Openeye Name:6-(benzenesulfonyl)-3,4-dihydroxy-2-nitro-benzonitrile
CAS Name:6-(benzenesulfonyl)-3,4-dihydroxy-2-nitrobenzonitrile
IUPAC Name:6-(benzenesulfonyl)-3,4-dihydroxy-2-nitrobenzonitrile
Traditional Name:6-besyl-3,4-dihydroxy-2-nitro-benzonitrile
Formula: C13H8N2O6S
MolecularWeight: 320.27742
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C13H8N2O6S/c14-7-9-11(6-10(16)13(17)12(9)15(18)19)22(20,21)8-4-2-1-3-5-8/h1-6,16-17H


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