2-(4-chlorophenyl)sulfonyl-5-nitro-benzoic acid

Systemtic Name: 2-(4-chlorophenyl)sulfonyl-5-nitro-benzoic acid Openeye Name: 2-(4-chlorophenyl)sulfonyl-5-nitro-benzoic acid CAS Name: 2-(4-chlorophenyl)sulfonyl-5-nitrobenzoic acid IUPAC Name: 2-(4-chlorophenyl)sulfonyl-5-nitrobenzoic acid Traditional Name: 2-(4-chlorophenyl)sulfonyl-5-nitro-benzoic acid Formula: C13H8ClNO6S MolecularWeight: 341.72372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)Cl

InChI

InChI=1S/C13H8ClNO6S/c14-8-1-4-10(5-2-8)22(20,21)12-6-3-9(15(18)19)7-11(12)13(16)17/h1-7H,(H,16,17)