pyridin-3-yl (4E)-3-methyl-4-[[3-(trifluoromethyl)phenyl]hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: pyridin-3-yl (4E)-3-methyl-4-[[3-(trifluoromethyl)phenyl]hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: 3-pyridyl (4E)-3-methyl-4-[[3-(trifluoromethyl)phenyl]hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[3-(trifluoromethyl)phenyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid 3-pyridinyl ester IUPAC Name: pyridin-3-yl (4E)-3-methyl-4-[[3-(trifluoromethyl)phenyl]hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-[[3-(trifluoromethyl)phenyl]hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylic acid 3-pyridyl ester Formula: C22H18F3N3O3 MolecularWeight: 429.39183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC3=CC=CC(=C3)C(F)(F)F)CCC2)C(=O)OC4=CN=CC=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC3=CC=CC(=C3)C(F)(F)F)/CCC2)C(=O)OC4=CN=CC=C4

InChI

InChI=1S/C22H18F3N3O3/c1-13-19-17(28-27-15-6-2-5-14(11-15)22(23,24)25)8-3-9-18(19)31-20(13)21(29)30-16-7-4-10-26-12-16/h2,4-7,10-12,27H,3,8-9H2,1H3/b28-17+