3-chloranyl-5-methoxy-4-(4-methoxy-3-nitro-phenyl)sulfonyloxy-benzoic acid

Systemtic Name: 3-chloranyl-5-methoxy-4-(4-methoxy-3-nitro-phenyl)sulfonyloxy-benzoic acid Openeye Name: 3-chloro-5-methoxy-4-(4-methoxy-3-nitro-phenyl)sulfonyloxy-benzoic acid CAS Name: 3-chloro-5-methoxy-4-(4-methoxy-3-nitrophenyl)sulfonyloxybenzoic acid IUPAC Name: 3-chloro-5-methoxy-4-(4-methoxy-3-nitrophenyl)sulfonyloxybenzoic acid Traditional Name: 3-chloro-5-methoxy-4-(4-methoxy-3-nitro-phenyl)sulfonyloxy-benzoic acid Formula: C15H12ClNO9S MolecularWeight: 417.77508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H12ClNO9S/c1-24-12-4-3-9(7-11(12)17(20)21)27(22,23)26-14-10(16)5-8(15(18)19)6-13(14)25-2/h3-7H,1-2H3,(H,18,19)