[2-(trifluoromethyl)phenyl]methyl 1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxylate

Systemtic Name: [2-(trifluoromethyl)phenyl]methyl 1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxylate Openeye Name: [2-(trifluoromethyl)phenyl]methyl 2-allyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-prop-2-enyl-5-isoindolecarboxylic acid [2-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [2-(trifluoromethyl)phenyl]methyl 1,3-dioxo-2-prop-2-enylisoindole-5-carboxylate Traditional Name: 2-allyl-1,3-diketo-isoindoline-5-carboxylic acid [2-(trifluoromethyl)benzyl] ester Formula: C20H14F3NO4 MolecularWeight: 389.32467

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C=CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C20H14F3NO4/c1-2-9-24-17(25)14-8-7-12(10-15(14)18(24)26)19(27)28-11-13-5-3-4-6-16(13)20(21,22)23/h2-8,10H,1,9,11H2