3-bromanyl-5-methoxy-4-(4-methylphenyl)sulfonyloxy-benzoic acid

Systemtic Name: 3-bromanyl-5-methoxy-4-(4-methylphenyl)sulfonyloxy-benzoic acid Openeye Name: 3-bromo-5-methoxy-4-(p-tolylsulfonyloxy)benzoic acid CAS Name: 3-bromo-5-methoxy-4-(4-methylphenyl)sulfonyloxybenzoic acid IUPAC Name: 3-bromo-5-methoxy-4-(4-methylphenyl)sulfonyloxybenzoic acid Traditional Name: 3-bromo-5-methoxy-4-tosyloxy-benzoic acid Formula: C15H13BrO6S MolecularWeight: 401.22912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C(=O)O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C(=O)O)OC

InChI

InChI=1S/C15H13BrO6S/c1-9-3-5-11(6-4-9)23(19,20)22-14-12(16)7-10(15(17)18)8-13(14)21-2/h3-8H,1-2H3,(H,17,18)