[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanoate

Systemtic Name: [2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanoate Openeye Name: [2-(3,5-dimethylanilino)-2-oxo-ethyl] 2-(1-methylene-3-oxo-isoindolin-2-yl)acetate CAS Name: 2-(1-methylene-3-oxo-2-isoindolyl)acetic acid [2-(3,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylanilino)-2-oxoethyl] 2-(1-methylidene-3-oxoisoindol-2-yl)acetate Traditional Name: 2-(1-keto-3-methylene-isoindolin-2-yl)acetic acid [2-(3,5-dimethylanilino)-2-keto-ethyl] ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)COC(=O)CN2C(=C)C3=CC=CC=C3C2=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)COC(=O)CN2C(=C)C3=CC=CC=C3C2=O)C

InChI

InChI=1S/C21H20N2O4/c1-13-8-14(2)10-16(9-13)22-19(24)12-27-20(25)11-23-15(3)17-6-4-5-7-18(17)21(23)26/h4-10H,3,11-12H2,1-2H3,(H,22,24)