3-[[2-(2-acetamido-5-bromanyl-phenyl)-2-oxidanylidene-ethanoyl]amino]benzoic acid

Systemtic Name: 3-[[2-(2-acetamido-5-bromanyl-phenyl)-2-oxidanylidene-ethanoyl]amino]benzoic acid Openeye Name: 3-[[2-(2-acetamido-5-bromo-phenyl)-2-oxo-acetyl]amino]benzoic acid CAS Name: 3-[[2-(2-acetamido-5-bromophenyl)-1,2-dioxoethyl]amino]benzoic acid IUPAC Name: 3-[[2-(2-acetamido-5-bromophenyl)-2-oxoacetyl]amino]benzoic acid Traditional Name: 3-[[2-(2-acetamido-5-bromo-phenyl)-2-keto-acetyl]amino]benzoic acid Formula: C17H13BrN2O5 MolecularWeight: 405.19952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)Br)C(=O)C(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)Br)C(=O)C(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C17H13BrN2O5/c1-9(21)19-14-6-5-11(18)8-13(14)15(22)16(23)20-12-4-2-3-10(7-12)17(24)25/h2-8H,1H3,(H,19,21)(H,20,23)(H,24,25)