3-nitro-4-phenoxy-benzenesulfonic acid

Systemtic Name: 3-nitro-4-phenoxy-benzenesulfonic acid Openeye Name: 3-nitro-4-phenoxy-benzenesulfonic acid CAS Name: 3-nitro-4-phenoxybenzenesulfonic acid IUPAC Name: 3-nitro-4-phenoxybenzenesulfonic acid Traditional Name: 3-nitro-4-phenoxy-besylic acid Formula: C12H9NO6S MolecularWeight: 295.26796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9NO6S/c14-13(15)11-8-10(20(16,17)18)6-7-12(11)19-9-4-2-1-3-5-9/h1-8H,(H,16,17,18)