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

Systemtic Name: 2-(3-ethanoylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(3-acetylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(3-acetylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(3-acetylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(3-acetylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C16H15NO3 MolecularWeight: 269.2952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO3/c1-10(18)11-5-4-6-12(9-11)17-15(19)13-7-2-3-8-14(13)16(17)20/h2-6,9,13-14H,7-8H2,1H3