3-[(4-bromanyl-2-methoxycarbonyl-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 3-[(4-bromanyl-2-methoxycarbonyl-phenyl)sulfonylamino]benzoic acid Openeye Name: 3-[(4-bromo-2-methoxycarbonyl-phenyl)sulfonylamino]benzoic acid CAS Name: 3-[(4-bromo-2-methoxycarbonylphenyl)sulfonylamino]benzoic acid IUPAC Name: 3-[(4-bromo-2-methoxycarbonylphenyl)sulfonylamino]benzoic acid Traditional Name: 3-[(4-bromo-2-carbomethoxy-phenyl)sulfonylamino]benzoic acid Formula: C15H12BrNO6S MolecularWeight: 414.22788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12BrNO6S/c1-23-15(20)12-8-10(16)5-6-13(12)24(21,22)17-11-4-2-3-9(7-11)14(18)19/h2-8,17H,1H3,(H,18,19)