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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CN1C(=O)C2=CC=CC=C2C1=O)Br

Isomeric SMILES

COC(=O)C(CN1C(=O)C2=CC=CC=C2C1=O)Br

InChI

InChI=1S/C12H10BrNO4/c1-18-12(17)9(13)6-14-10(15)7-4-2-3-5-8(7)11(14)16/h2-5,9H,6H2,1H3