3-chloranyl-4-(3,4-dimethoxyphenyl)sulfonyloxy-5-methoxy-benzoic acid

Systemtic Name: 3-chloranyl-4-(3,4-dimethoxyphenyl)sulfonyloxy-5-methoxy-benzoic acid Openeye Name: 3-chloro-4-(3,4-dimethoxyphenyl)sulfonyloxy-5-methoxy-benzoic acid CAS Name: 3-chloro-4-(3,4-dimethoxyphenyl)sulfonyloxy-5-methoxybenzoic acid IUPAC Name: 3-chloro-4-(3,4-dimethoxyphenyl)sulfonyloxy-5-methoxybenzoic acid Traditional Name: 3-chloro-4-(3,4-dimethoxyphenyl)sulfonyloxy-5-methoxy-benzoic acid Formula: C16H15ClO8S MolecularWeight: 402.8035

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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)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC)OC

InChI

InChI=1S/C16H15ClO8S/c1-22-12-5-4-10(8-13(12)23-2)26(20,21)25-15-11(17)6-9(16(18)19)7-14(15)24-3/h4-8H,1-3H3,(H,18,19)