3-(3,4-dichlorophenyl)-3-[2-methyl-3-oxidanylidene-4-(trifluoromethyl)-1H-isoindol-1-yl]propanal

Systemtic Name: 3-(3,4-dichlorophenyl)-3-[2-methyl-3-oxidanylidene-4-(trifluoromethyl)-1H-isoindol-1-yl]propanal Openeye Name: 3-(3,4-dichlorophenyl)-3-[2-methyl-3-oxo-4-(trifluoromethyl)isoindolin-1-yl]propanal CAS Name: 3-(3,4-dichlorophenyl)-3-[2-methyl-3-oxo-4-(trifluoromethyl)-1H-isoindol-1-yl]propanal IUPAC Name: 3-(3,4-dichlorophenyl)-3-[2-methyl-3-oxo-4-(trifluoromethyl)-1H-isoindol-1-yl]propanal Traditional Name: 3-(3,4-dichlorophenyl)-3-[3-keto-2-methyl-4-(trifluoromethyl)isoindolin-1-yl]propionaldehyde Formula: C19H14Cl2F3NO2 MolecularWeight: 416.22117

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C2=C(C1=O)C(=CC=C2)C(F)(F)F)C(CC=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CN1C(C2=C(C1=O)C(=CC=C2)C(F)(F)F)C(CC=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H14Cl2F3NO2/c1-25-17(11(7-8-26)10-5-6-14(20)15(21)9-10)12-3-2-4-13(19(22,23)24)16(12)18(25)27/h2-6,8-9,11,17H,7H2,1H3