2-butyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-butyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-butyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-butyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-butyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-butyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2CC=CCC2C1=O

Isomeric SMILES

CCCCN1C(=O)C2CC=CCC2C1=O

InChI

InChI=1S/C12H17NO2/c1-2-3-8-13-11(14)9-6-4-5-7-10(9)12(13)15/h4-5,9-10H,2-3,6-8H2,1H3