4,7-bis(chloranyl)-2-(3-methylbutyl)isoindole-1,3-dione

Systemtic Name: 4,7-bis(chloranyl)-2-(3-methylbutyl)isoindole-1,3-dione Openeye Name: 4,7-dichloro-2-isopentyl-isoindoline-1,3-dione CAS Name: 4,7-dichloro-2-(3-methylbutyl)isoindole-1,3-dione IUPAC Name: 4,7-dichloro-2-(3-methylbutyl)isoindole-1,3-dione Traditional Name: 4,7-dichloro-2-isoamyl-isoindoline-1,3-quinone Formula: C13H13Cl2NO2 MolecularWeight: 286.15382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C=CC(=C2C1=O)Cl)Cl

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C=CC(=C2C1=O)Cl)Cl

InChI

InChI=1S/C13H13Cl2NO2/c1-7(2)5-6-16-12(17)10-8(14)3-4-9(15)11(10)13(16)18/h3-4,7H,5-6H2,1-2H3