5-bromanyl-2-[[8-[(4-bromanyl-2-carboxy-phenyl)amino]-8-oxidanylidene-octanoyl]amino]benzoic acid

Systemtic Name: 5-bromanyl-2-[[8-[(4-bromanyl-2-carboxy-phenyl)amino]-8-oxidanylidene-octanoyl]amino]benzoic acid Openeye Name: 5-bromo-2-[[8-(4-bromo-2-carboxy-anilino)-8-oxo-octanoyl]amino]benzoic acid CAS Name: 5-bromo-2-[[8-(4-bromo-2-carboxyanilino)-1,8-dioxooctyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[8-(4-bromo-2-carboxyanilino)-8-oxooctanoyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[8-(4-bromo-2-carboxy-anilino)-8-keto-octanoyl]amino]benzoic acid Formula: C22H22Br2N2O6 MolecularWeight: 570.22788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22Br2N2O6/c23-13-7-9-17(15(11-13)21(29)30)25-19(27)5-3-1-2-4-6-20(28)26-18-10-8-14(24)12-16(18)22(31)32/h7-12H,1-6H2,(H,25,27)(H,26,28)(H,29,30)(H,31,32)