(4-chlorophenyl) 4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: (4-chlorophenyl) 4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: (4-chlorophenyl) 4-(5-bromo-1,3-dioxo-isoindolin-2-yl)butanoate CAS Name: 4-(5-bromo-1,3-dioxo-2-isoindolyl)butanoic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 4-(5-bromo-1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-(5-bromo-1,3-diketo-isoindolin-2-yl)butyric acid (4-chlorophenyl) ester Formula: C18H13BrClNO4 MolecularWeight: 422.65712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1OC(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)Cl

InChI

InChI=1S/C18H13BrClNO4/c19-11-3-8-14-15(10-11)18(24)21(17(14)23)9-1-2-16(22)25-13-6-4-12(20)5-7-13/h3-8,10H,1-2,9H2