2-(1,3-benzodioxol-5-yl)-4-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(1,3-benzodioxol-5-yl)-4-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CCC2C1C(=O)N(C2=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1C=CCC2C1C(=O)N(C2=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H15NO4/c1-9-3-2-4-11-14(9)16(19)17(15(11)18)10-5-6-12-13(7-10)21-8-20-12/h2-3,5-7,9,11,14H,4,8H2,1H3