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

Systemtic Name: 3-chloranyl-4-(4-chloranyl-3-nitro-phenyl)sulfonyloxy-5-methoxy-benzoic acid Openeye Name: 3-chloro-4-(4-chloro-3-nitro-phenyl)sulfonyloxy-5-methoxy-benzoic acid CAS Name: 3-chloro-4-(4-chloro-3-nitrophenyl)sulfonyloxy-5-methoxybenzoic acid IUPAC Name: 3-chloro-4-(4-chloro-3-nitrophenyl)sulfonyloxy-5-methoxybenzoic acid Traditional Name: 3-chloro-4-(4-chloro-3-nitro-phenyl)sulfonyloxy-5-methoxy-benzoic acid Formula: C14H9Cl2NO8S MolecularWeight: 422.19416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H9Cl2NO8S/c1-24-12-5-7(14(18)19)4-10(16)13(12)25-26(22,23)8-2-3-9(15)11(6-8)17(20)21/h2-6H,1H3,(H,18,19)