(3,5-dinitro-4-oxidanyl-phenyl) benzenesulfonate

Systemtic Name: (3,5-dinitro-4-oxidanyl-phenyl) benzenesulfonate Openeye Name: (4-hydroxy-3,5-dinitro-phenyl) benzenesulfonate CAS Name: benzenesulfonic acid (4-hydroxy-3,5-dinitrophenyl) ester IUPAC Name: (4-hydroxy-3,5-dinitrophenyl) benzenesulfonate Traditional Name: benzenesulfonic acid (4-hydroxy-3,5-dinitro-phenyl) ester Formula: C12H8N2O8S MolecularWeight: 340.26552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C(=C2)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C(=C2)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C12H8N2O8S/c15-12-10(13(16)17)6-8(7-11(12)14(18)19)22-23(20,21)9-4-2-1-3-5-9/h1-7,15H