2-(4-methylpentyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Systemtic Name: 2-(4-methylpentyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Openeye Name: 2-isohexyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione CAS Name: 2-(4-methylpentyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione IUPAC Name: 2-(4-methylpentyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Traditional Name: 2-isohexyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-quinone Formula: C14H23NO2 MolecularWeight: 237.33792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCN1C(=O)C2CCCCC2C1=O

Isomeric SMILES

CC(C)CCCN1C(=O)C2CCCCC2C1=O

InChI

InChI=1S/C14H23NO2/c1-10(2)6-5-9-15-13(16)11-7-3-4-8-12(11)14(15)17/h10-12H,3-9H2,1-2H3