3-nitro-4-(phenylsulfonyl)benzoic acid

Systemtic Name: 3-nitro-4-(phenylsulfonyl)benzoic acid Openeye Name: 4-(benzenesulfonyl)-3-nitro-benzoic acid CAS Name: 4-(benzenesulfonyl)-3-nitrobenzoic acid IUPAC Name: 4-(benzenesulfonyl)-3-nitrobenzoic acid Traditional Name: 4-besyl-3-nitro-benzoic acid Formula: C13H9NO6S MolecularWeight: 307.27866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9NO6S/c15-13(16)9-6-7-12(11(8-9)14(17)18)21(19,20)10-4-2-1-3-5-10/h1-8H,(H,15,16)