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

Systemtic Name: phenacyl 2-(3,4-dimethylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: phenacyl 2-(3,4-dimethylphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(3,4-dimethylphenyl)-1,3-dioxo-5-isoindolecarboxylic acid phenacyl ester IUPAC Name: phenacyl 2-(3,4-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(3,4-dimethylphenyl)-1,3-diketo-isoindoline-5-carboxylic acid phenacyl ester Formula: C25H19NO5 MolecularWeight: 413.42206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H19NO5/c1-15-8-10-19(12-16(15)2)26-23(28)20-11-9-18(13-21(20)24(26)29)25(30)31-14-22(27)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3