2-[(2-bromophenyl)carbonyl-(furan-2-ylmethyl)amino]-4-chloranyl-5-sulfamoyl-benzoic acid

Systemtic Name: 2-[(2-bromophenyl)carbonyl-(furan-2-ylmethyl)amino]-4-chloranyl-5-sulfamoyl-benzoic acid Openeye Name: 2-[(2-bromobenzoyl)-(2-furylmethyl)amino]-4-chloro-5-sulfamoyl-benzoic acid CAS Name: 2-[[(2-bromophenyl)-oxomethyl]-(2-furanylmethyl)amino]-4-chloro-5-sulfamoylbenzoic acid IUPAC Name: 2-[(2-bromobenzoyl)-(furan-2-ylmethyl)amino]-4-chloro-5-sulfamoylbenzoic acid Traditional Name: 2-[(2-bromobenzoyl)-(2-furfuryl)amino]-4-chloro-5-sulfamoyl-benzoic acid Formula: C19H14BrClN2O6S MolecularWeight: 513.74626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N(CC2=CC=CO2)C3=CC(=C(C=C3C(=O)O)S(=O)(=O)N)Cl)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N(CC2=CC=CO2)C3=CC(=C(C=C3C(=O)O)S(=O)(=O)N)Cl)Br

InChI

InChI=1S/C19H14BrClN2O6S/c20-14-6-2-1-5-12(14)18(24)23(10-11-4-3-7-29-11)16-9-15(21)17(30(22,27)28)8-13(16)19(25)26/h1-9H,10H2,(H,25,26)(H2,22,27,28)