5-prop-2-enyl-4-[4-(trifluoromethyl)phenyl]isoindole-1,3-dione

Systemtic Name: 5-prop-2-enyl-4-[4-(trifluoromethyl)phenyl]isoindole-1,3-dione Openeye Name: 5-allyl-4-[4-(trifluoromethyl)phenyl]isoindoline-1,3-dione CAS Name: 5-prop-2-enyl-4-[4-(trifluoromethyl)phenyl]isoindole-1,3-dione IUPAC Name: 5-prop-2-enyl-4-[4-(trifluoromethyl)phenyl]isoindole-1,3-dione Traditional Name: 5-allyl-4-[4-(trifluoromethyl)phenyl]isoindoline-1,3-quinone Formula: C18H12F3NO2 MolecularWeight: 331.28859

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C2=C(C=C1)C(=O)NC2=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C=CCC1=C(C2=C(C=C1)C(=O)NC2=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H12F3NO2/c1-2-3-10-6-9-13-15(17(24)22-16(13)23)14(10)11-4-7-12(8-5-11)18(19,20)21/h2,4-9H,1,3H2,(H,22,23,24)