5-bromanyl-2-[2-[3-[2-[(4-bromanyl-2-carboxy-phenyl)amino]-2-oxidanylidene-ethyl]phenyl]ethanoylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[2-[3-[2-[(4-bromanyl-2-carboxy-phenyl)amino]-2-oxidanylidene-ethyl]phenyl]ethanoylamino]benzoic acid Openeye Name: 5-bromo-2-[[2-[3-[2-(4-bromo-2-carboxy-anilino)-2-oxo-ethyl]phenyl]acetyl]amino]benzoic acid CAS Name: 5-bromo-2-[[2-[3-[2-(4-bromo-2-carboxyanilino)-2-oxoethyl]phenyl]-1-oxoethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[2-[3-[2-(4-bromo-2-carboxyanilino)-2-oxoethyl]phenyl]acetyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[2-[3-[2-(4-bromo-2-carboxy-anilino)-2-keto-ethyl]phenyl]acetyl]amino]benzoic acid Formula: C24H18Br2N2O6 MolecularWeight: 590.21752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CC(=O)NC2=C(C=C(C=C2)Br)C(=O)O)CC(=O)NC3=C(C=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CC(=O)NC2=C(C=C(C=C2)Br)C(=O)O)CC(=O)NC3=C(C=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C24H18Br2N2O6/c25-15-4-6-19(17(11-15)23(31)32)27-21(29)9-13-2-1-3-14(8-13)10-22(30)28-20-7-5-16(26)12-18(20)24(33)34/h1-8,11-12H,9-10H2,(H,27,29)(H,28,30)(H,31,32)(H,33,34)