3-[(4-bromanyl-3-methoxy-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 3-[(4-bromanyl-3-methoxy-phenyl)sulfonylamino]benzoic acid Openeye Name: 3-[(4-bromo-3-methoxy-phenyl)sulfonylamino]benzoic acid CAS Name: 3-[(4-bromo-3-methoxyphenyl)sulfonylamino]benzoic acid IUPAC Name: 3-[(4-bromo-3-methoxyphenyl)sulfonylamino]benzoic acid Traditional Name: 3-[(4-bromo-3-methoxy-phenyl)sulfonylamino]benzoic acid Formula: C14H12BrNO5S MolecularWeight: 386.21778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)O)Br

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)O)Br

InChI

InChI=1S/C14H12BrNO5S/c1-21-13-8-11(5-6-12(13)15)22(19,20)16-10-4-2-3-9(7-10)14(17)18/h2-8,16H,1H3,(H,17,18)