5-(3-ethanoylphenyl)carbonyl-2-methyl-isoindole-1,3-dione

Systemtic Name: 5-(3-ethanoylphenyl)carbonyl-2-methyl-isoindole-1,3-dione Openeye Name: 5-(3-acetylbenzoyl)-2-methyl-isoindoline-1,3-dione CAS Name: 5-[(3-acetylphenyl)-oxomethyl]-2-methylisoindole-1,3-dione IUPAC Name: 5-(3-acetylbenzoyl)-2-methylisoindole-1,3-dione Traditional Name: 5-(3-acetylbenzoyl)-2-methyl-isoindoline-1,3-quinone Formula: C18H13NO4 MolecularWeight: 307.30012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC(=C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C

Isomeric SMILES

CC(=O)C1=CC=CC(=C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C

InChI

InChI=1S/C18H13NO4/c1-10(20)11-4-3-5-12(8-11)16(21)13-6-7-14-15(9-13)18(23)19(2)17(14)22/h3-9H,1-2H3