methyl 2-[[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-oxidanylidene-butanoate

Systemtic Name: methyl 2-[[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-oxidanylidene-butanoate Openeye Name: methyl 2-[(5-bromo-1,3-dioxo-isoindolin-2-yl)methyl]-3-oxo-butanoate CAS Name: 2-[(5-bromo-1,3-dioxo-2-isoindolyl)methyl]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 2-[(5-bromo-1,3-dioxoisoindol-2-yl)methyl]-3-oxobutanoate Traditional Name: 2-[(5-bromo-1,3-diketo-isoindolin-2-yl)methyl]-3-keto-butyric acid methyl ester Formula: C14H12BrNO5 MolecularWeight: 354.15278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CN1C(=O)C2=C(C1=O)C=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CC(=O)C(CN1C(=O)C2=C(C1=O)C=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C14H12BrNO5/c1-7(17)11(14(20)21-2)6-16-12(18)9-4-3-8(15)5-10(9)13(16)19/h3-5,11H,6H2,1-2H3