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

Systemtic Name: 2-[(5-bromanyl-2-oxidanyl-phenyl)carbonyl-(furan-2-ylmethyl)amino]-4-chloranyl-5-sulfamoyl-benzoic acid Openeye Name: 2-[(5-bromo-2-hydroxy-benzoyl)-(2-furylmethyl)amino]-4-chloro-5-sulfamoyl-benzoic acid CAS Name: 2-[[(5-bromo-2-hydroxyphenyl)-oxomethyl]-(2-furanylmethyl)amino]-4-chloro-5-sulfamoylbenzoic acid IUPAC Name: 2-[(5-bromo-2-hydroxybenzoyl)-(furan-2-ylmethyl)amino]-4-chloro-5-sulfamoylbenzoic acid Traditional Name: 2-[(5-bromo-2-hydroxy-benzoyl)-(2-furfuryl)amino]-4-chloro-5-sulfamoyl-benzoic acid Formula: C19H14BrClN2O7S MolecularWeight: 529.74566

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN(C2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl)C(=O)C3=C(C=CC(=C3)Br)O

Isomeric SMILES

C1=COC(=C1)CN(C2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl)C(=O)C3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C19H14BrClN2O7S/c20-10-3-4-16(24)13(6-10)18(25)23(9-11-2-1-5-30-11)15-8-14(21)17(31(22,28)29)7-12(15)19(26)27/h1-8,24H,9H2,(H,26,27)(H2,22,28,29)