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

Systemtic Name: 5-bromanyl-2-[[2-(2-methoxyethyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoic acid Openeye Name: 5-bromo-2-[[2-(2-methoxyethyl)-1,3-dioxo-isoindoline-5-carbonyl]amino]benzoic acid CAS Name: 5-bromo-2-[[[2-(2-methoxyethyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[2-(2-methoxyethyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[1,3-diketo-2-(2-methoxyethyl)isoindoline-5-carbonyl]amino]benzoic acid Formula: C19H15BrN2O6 MolecularWeight: 447.2362

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)O

Isomeric SMILES

COCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C19H15BrN2O6/c1-28-7-6-22-17(24)12-4-2-10(8-13(12)18(22)25)16(23)21-15-5-3-11(20)9-14(15)19(26)27/h2-5,8-9H,6-7H2,1H3,(H,21,23)(H,26,27)