5,6-bis(chloranyl)-2-(3,3-dimethyl-2-oxidanylidene-butyl)isoindole-1,3-dione

Systemtic Name: 5,6-bis(chloranyl)-2-(3,3-dimethyl-2-oxidanylidene-butyl)isoindole-1,3-dione Openeye Name: 5,6-dichloro-2-(3,3-dimethyl-2-oxo-butyl)isoindoline-1,3-dione CAS Name: 5,6-dichloro-2-(3,3-dimethyl-2-oxobutyl)isoindole-1,3-dione IUPAC Name: 5,6-dichloro-2-(3,3-dimethyl-2-oxobutyl)isoindole-1,3-dione Traditional Name: 5,6-dichloro-2-(2-keto-3,3-dimethyl-butyl)isoindoline-1,3-quinone Formula: C14H13Cl2NO3 MolecularWeight: 314.16392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C(=O)C2=CC(=C(C=C2C1=O)Cl)Cl

Isomeric SMILES

CC(C)(C)C(=O)CN1C(=O)C2=CC(=C(C=C2C1=O)Cl)Cl

InChI

InChI=1S/C14H13Cl2NO3/c1-14(2,3)11(18)6-17-12(19)7-4-9(15)10(16)5-8(7)13(17)20/h4-5H,6H2,1-3H3