1-(2,4-dimethylphenyl)-3-(phenylcarbonyl)benzo[f][2]benzofuran-4,9-dione

Systemtic Name: 1-(2,4-dimethylphenyl)-3-(phenylcarbonyl)benzo[f][2]benzofuran-4,9-dione Openeye Name: 3-benzoyl-1-(2,4-dimethylphenyl)benzo[f]isobenzofuran-4,9-dione CAS Name: 3-benzoyl-1-(2,4-dimethylphenyl)benzo[f]isobenzofuran-4,9-dione IUPAC Name: 3-benzoyl-1-(2,4-dimethylphenyl)benzo[f][2]benzofuran-4,9-dione Traditional Name: 3-benzoyl-1-(2,4-dimethylphenyl)benz[f]isobenzofuran-4,9-quinone Formula: C27H18O4 MolecularWeight: 406.42942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C3C(=C(O2)C(=O)C4=CC=CC=C4)C(=O)C5=CC=CC=C5C3=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C3C(=C(O2)C(=O)C4=CC=CC=C4)C(=O)C5=CC=CC=C5C3=O)C

InChI

InChI=1S/C27H18O4/c1-15-12-13-18(16(2)14-15)26-21-22(25(30)20-11-7-6-10-19(20)24(21)29)27(31-26)23(28)17-8-4-3-5-9-17/h3-14H,1-2H3