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

Systemtic Name: phenacyl 1,3-bis(oxidanylidene)-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate Openeye Name: phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]-5-isoindolecarboxylic acid phenacyl ester IUPAC Name: phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate Traditional Name: 1,3-diketo-2-[3-(trifluoromethyl)phenyl]isoindoline-5-carboxylic acid phenacyl ester Formula: C24H14F3NO5 MolecularWeight: 453.36687

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C24H14F3NO5/c25-24(26,27)16-7-4-8-17(12-16)28-21(30)18-10-9-15(11-19(18)22(28)31)23(32)33-13-20(29)14-5-2-1-3-6-14/h1-12H,13H2