2-(3,3-dimethyl-2-oxidanylidene-butyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Systemtic Name: 2-(3,3-dimethyl-2-oxidanylidene-butyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Openeye Name: 2-(3,3-dimethyl-2-oxo-butyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione CAS Name: 2-(3,3-dimethyl-2-oxobutyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione IUPAC Name: 2-(3,3-dimethyl-2-oxobutyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Traditional Name: 2-(2-keto-3,3-dimethyl-butyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-quinone Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C(=O)C2CCCCC2C1=O

Isomeric SMILES

CC(C)(C)C(=O)CN1C(=O)C2CCCCC2C1=O

InChI

InChI=1S/C14H21NO3/c1-14(2,3)11(16)8-15-12(17)9-6-4-5-7-10(9)13(15)18/h9-10H,4-8H2,1-3H3