phenacyl 2-(4-ethanoylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: phenacyl 2-(4-ethanoylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: phenacyl 2-(4-acetylphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-acetylphenyl)-1,3-dioxo-5-isoindolecarboxylic acid phenacyl ester IUPAC Name: phenacyl 2-(4-acetylphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(4-acetylphenyl)-1,3-diketo-isoindoline-5-carboxylic acid phenacyl ester Formula: C25H17NO6 MolecularWeight: 427.40558

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H17NO6/c1-15(27)16-7-10-19(11-8-16)26-23(29)20-12-9-18(13-21(20)24(26)30)25(31)32-14-22(28)17-5-3-2-4-6-17/h2-13H,14H2,1H3