5-bromanyl-2-[[2-(3-methoxyphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[[2-(3-methoxyphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoic acid Openeye Name: 5-bromo-2-[[2-(3-methoxyphenyl)-1,3-dioxo-isoindoline-5-carbonyl]amino]benzoic acid CAS Name: 5-bromo-2-[[[2-(3-methoxyphenyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[2-(3-methoxyphenyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[1,3-diketo-2-(3-methoxyphenyl)isoindoline-5-carbonyl]amino]benzoic acid Formula: C23H15BrN2O6 MolecularWeight: 495.279

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=C(C=C(C=C4)Br)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=C(C=C(C=C4)Br)C(=O)O

InChI

InChI=1S/C23H15BrN2O6/c1-32-15-4-2-3-14(11-15)26-21(28)16-7-5-12(9-17(16)22(26)29)20(27)25-19-8-6-13(24)10-18(19)23(30)31/h2-11H,1H3,(H,25,27)(H,30,31)