4-(5-bromanyl-2-ethoxy-phenyl)sulfonyloxy-3-chloranyl-5-methoxy-benzoic acid

Systemtic Name: 4-(5-bromanyl-2-ethoxy-phenyl)sulfonyloxy-3-chloranyl-5-methoxy-benzoic acid Openeye Name: 4-(5-bromo-2-ethoxy-phenyl)sulfonyloxy-3-chloro-5-methoxy-benzoic acid CAS Name: 4-(5-bromo-2-ethoxyphenyl)sulfonyloxy-3-chloro-5-methoxybenzoic acid IUPAC Name: 4-(5-bromo-2-ethoxyphenyl)sulfonyloxy-3-chloro-5-methoxybenzoic acid Traditional Name: 4-(5-bromo-2-ethoxy-phenyl)sulfonyloxy-3-chloro-5-methoxy-benzoic acid Formula: C16H14BrClO7S MolecularWeight: 465.70016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrClO7S/c1-3-24-12-5-4-10(17)8-14(12)26(21,22)25-15-11(18)6-9(16(19)20)7-13(15)23-2/h4-8H,3H2,1-2H3,(H,19,20)