3-chloranylsulfonyl-5-nitro-4-phenyl-benzoic acid

Systemtic Name: 3-chloranylsulfonyl-5-nitro-4-phenyl-benzoic acid Openeye Name: 3-chlorosulfonyl-5-nitro-4-phenyl-benzoic acid CAS Name: 3-chlorosulfonyl-5-nitro-4-phenylbenzoic acid IUPAC Name: 3-chlorosulfonyl-5-nitro-4-phenylbenzoic acid Traditional Name: 3-chlorosulfonyl-5-nitro-4-phenyl-benzoic acid Formula: C13H8ClNO6S MolecularWeight: 341.72372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2S(=O)(=O)Cl)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2S(=O)(=O)Cl)C(=O)O)[N+](=O)[O-]

InChI

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