3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl ethanoate

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl ethanoate Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)propyl acetate CAS Name: acetic acid 3-(5-bromo-1,3-dioxo-2-isoindolyl)propyl ester IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)propyl acetate Traditional Name: acetic acid 3-(5-bromo-1,3-diketo-isoindolin-2-yl)propyl ester Formula: C13H12BrNO4 MolecularWeight: 326.14268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCN1C(=O)C2=C(C1=O)C=C(C=C2)Br

Isomeric SMILES

CC(=O)OCCCN1C(=O)C2=C(C1=O)C=C(C=C2)Br

InChI

InChI=1S/C13H12BrNO4/c1-8(16)19-6-2-5-15-12(17)10-4-3-9(14)7-11(10)13(15)18/h3-4,7H,2,5-6H2,1H3