3-bromanyl-4-(2-ethylsulfonylethoxy)-5-methoxy-benzoic acid

Systemtic Name: 3-bromanyl-4-(2-ethylsulfonylethoxy)-5-methoxy-benzoic acid Openeye Name: 3-bromo-4-(2-ethylsulfonylethoxy)-5-methoxy-benzoic acid CAS Name: 3-bromo-4-(2-ethylsulfonylethoxy)-5-methoxybenzoic acid IUPAC Name: 3-bromo-4-(2-ethylsulfonylethoxy)-5-methoxybenzoic acid Traditional Name: 3-bromo-4-(2-esylethoxy)-5-methoxy-benzoic acid Formula: C12H15BrO6S MolecularWeight: 367.2129

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CCOC1=C(C=C(C=C1Br)C(=O)O)OC

Isomeric SMILES

CCS(=O)(=O)CCOC1=C(C=C(C=C1Br)C(=O)O)OC

InChI

InChI=1S/C12H15BrO6S/c1-3-20(16,17)5-4-19-11-9(13)6-8(12(14)15)7-10(11)18-2/h6-7H,3-5H2,1-2H3,(H,14,15)