2-(2,6-dimethylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(2,6-dimethylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(2,6-dimethylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(2,6-dimethylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(2,6-dimethylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(2,6-dimethylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)C3CC=CCC3C2=O

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3CC=CCC3C2=O

InChI

InChI=1S/C16H17NO2/c1-10-6-5-7-11(2)14(10)17-15(18)12-8-3-4-9-13(12)16(17)19/h3-7,12-13H,8-9H2,1-2H3