3-chloranyl-4-(4-ethoxycarbonylphenyl)sulfonyloxy-5-methoxy-benzoic acid

Systemtic Name: 3-chloranyl-4-(4-ethoxycarbonylphenyl)sulfonyloxy-5-methoxy-benzoic acid Openeye Name: 3-chloro-4-(4-ethoxycarbonylphenyl)sulfonyloxy-5-methoxy-benzoic acid CAS Name: 3-chloro-4-(4-ethoxycarbonylphenyl)sulfonyloxy-5-methoxybenzoic acid IUPAC Name: 3-chloro-4-(4-ethoxycarbonylphenyl)sulfonyloxy-5-methoxybenzoic acid Traditional Name: 4-(4-carbethoxyphenyl)sulfonyloxy-3-chloro-5-methoxy-benzoic acid Formula: C17H15ClO8S MolecularWeight: 414.8142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC

InChI

InChI=1S/C17H15ClO8S/c1-3-25-17(21)10-4-6-12(7-5-10)27(22,23)26-15-13(18)8-11(16(19)20)9-14(15)24-2/h4-9H,3H2,1-2H3,(H,19,20)