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

Systemtic Name: 5-bromanyl-2-[2-[2-[(4-bromanyl-2-carboxy-phenyl)amino]-2-oxidanylidene-ethoxy]ethanoylamino]benzoic acid Openeye Name: 5-bromo-2-[[2-[2-(4-bromo-2-carboxy-anilino)-2-oxo-ethoxy]acetyl]amino]benzoic acid CAS Name: 5-bromo-2-[[2-[2-(4-bromo-2-carboxyanilino)-2-oxoethoxy]-1-oxoethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[2-[2-(4-bromo-2-carboxyanilino)-2-oxoethoxy]acetyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[2-[2-(4-bromo-2-carboxy-anilino)-2-keto-ethoxy]acetyl]amino]benzoic acid Formula: C18H14Br2N2O7 MolecularWeight: 530.12096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C(=O)O)NC(=O)COCC(=O)NC2=C(C=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)C(=O)O)NC(=O)COCC(=O)NC2=C(C=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C18H14Br2N2O7/c19-9-1-3-13(11(5-9)17(25)26)21-15(23)7-29-8-16(24)22-14-4-2-10(20)6-12(14)18(27)28/h1-6H,7-8H2,(H,21,23)(H,22,24)(H,25,26)(H,27,28)