4-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-bromanyl-butanoic acid

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-bromanyl-butanoic acid Openeye Name: 2-bromo-4-(1,3-dioxoisoindolin-2-yl)butanoic acid CAS Name: 2-bromo-4-(1,3-dioxo-2-isoindolyl)butanoic acid IUPAC Name: 2-bromo-4-(1,3-dioxoisoindol-2-yl)butanoic acid Traditional Name: 2-bromo-4-phthalimido-butyric acid Formula: C12H10BrNO4 MolecularWeight: 312.1161

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(C(=O)O)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(C(=O)O)Br

InChI

InChI=1S/C12H10BrNO4/c13-9(12(17)18)5-6-14-10(15)7-3-1-2-4-8(7)11(14)16/h1-4,9H,5-6H2,(H,17,18)