3-[[2-bromanyl-5-[(4-bromophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid

Systemtic Name: 3-[[2-bromanyl-5-[(4-bromophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid Openeye Name: 3-[[2-bromo-5-[(4-bromophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid CAS Name: 3-[[2-bromo-5-[(4-bromoanilino)-oxomethyl]phenyl]sulfonylamino]benzoic acid IUPAC Name: 3-[[2-bromo-5-[(4-bromophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid Traditional Name: 3-[[2-bromo-5-[(4-bromophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid Formula: C20H14Br2N2O5S MolecularWeight: 554.20856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)Br)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)Br)Br)C(=O)O

InChI

InChI=1S/C20H14Br2N2O5S/c21-14-5-7-15(8-6-14)23-19(25)12-4-9-17(22)18(11-12)30(28,29)24-16-3-1-2-13(10-16)20(26)27/h1-11,24H,(H,23,25)(H,26,27)