5-bromanyl-2-butyl-isoindole-1,3-dione

Systemtic Name: 5-bromanyl-2-butyl-isoindole-1,3-dione Openeye Name: 5-bromo-2-butyl-isoindoline-1,3-dione CAS Name: 5-bromo-2-butylisoindole-1,3-dione IUPAC Name: 5-bromo-2-butylisoindole-1,3-dione Traditional Name: 5-bromo-2-butyl-isoindoline-1,3-quinone Formula: C12H12BrNO2 MolecularWeight: 282.13318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)Br

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)Br

InChI

InChI=1S/C12H12BrNO2/c1-2-3-6-14-11(15)9-5-4-8(13)7-10(9)12(14)16/h4-5,7H,2-3,6H2,1H3