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

Systemtic Name: 3-chloranyl-4-(3,4-diethoxyphenyl)sulfonyloxy-5-methoxy-benzoic acid Openeye Name: 3-chloro-4-(3,4-diethoxyphenyl)sulfonyloxy-5-methoxy-benzoic acid CAS Name: 3-chloro-4-(3,4-diethoxyphenyl)sulfonyloxy-5-methoxybenzoic acid IUPAC Name: 3-chloro-4-(3,4-diethoxyphenyl)sulfonyloxy-5-methoxybenzoic acid Traditional Name: 3-chloro-4-(3,4-diethoxyphenyl)sulfonyloxy-5-methoxy-benzoic acid Formula: C18H19ClO8S MolecularWeight: 430.85666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC)OCC

InChI

InChI=1S/C18H19ClO8S/c1-4-25-14-7-6-12(10-15(14)26-5-2)28(22,23)27-17-13(19)8-11(18(20)21)9-16(17)24-3/h6-10H,4-5H2,1-3H3,(H,20,21)