4-[(2-bromanyl-4-ethoxycarbonyl-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 4-[(2-bromanyl-4-ethoxycarbonyl-phenyl)sulfonylamino]benzoic acid Openeye Name: 4-[(2-bromo-4-ethoxycarbonyl-phenyl)sulfonylamino]benzoic acid CAS Name: 4-[(2-bromo-4-ethoxycarbonylphenyl)sulfonylamino]benzoic acid IUPAC Name: 4-[(2-bromo-4-ethoxycarbonylphenyl)sulfonylamino]benzoic acid Traditional Name: 4-[(2-bromo-4-carbethoxy-phenyl)sulfonylamino]benzoic acid Formula: C16H14BrNO6S MolecularWeight: 428.25446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrNO6S/c1-2-24-16(21)11-5-8-14(13(17)9-11)25(22,23)18-12-6-3-10(4-7-12)15(19)20/h3-9,18H,2H2,1H3,(H,19,20)