[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 4-(3,4-dimethylphenyl)-4-oxo-butanoate CAS Name: 4-(3,4-dimethylphenyl)-4-oxobutanoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 4-(3,4-dimethylphenyl)-4-oxobutanoate Traditional Name: 4-(3,4-dimethylphenyl)-4-keto-butyric acid phthalimidomethyl ester Formula: C21H19NO5 MolecularWeight: 365.37926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CCC(=O)OCN2C(=O)C3=CC=CC=C3C2=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CCC(=O)OCN2C(=O)C3=CC=CC=C3C2=O)C

InChI

InChI=1S/C21H19NO5/c1-13-7-8-15(11-14(13)2)18(23)9-10-19(24)27-12-22-20(25)16-5-3-4-6-17(16)21(22)26/h3-8,11H,9-10,12H2,1-2H3