(6E)-4-chloranyl-6-[1-pyridin-4-ylcarbonyl-5-[4-(trifluoromethyl)phenyl]pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-4-chloranyl-6-[1-pyridin-4-ylcarbonyl-5-[4-(trifluoromethyl)phenyl]pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-4-chloro-6-[1-(pyridine-4-carbonyl)-5-[4-(trifluoromethyl)phenyl]pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-4-chloro-6-[1-[oxo(pyridin-4-yl)methyl]-5-[4-(trifluoromethyl)phenyl]-3-pyrazolidinylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-4-chloro-6-[1-(pyridine-4-carbonyl)-5-[4-(trifluoromethyl)phenyl]pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-4-chloro-6-[1-isonicotinoyl-5-[4-(trifluoromethyl)phenyl]pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C22H15ClF3N3O2 MolecularWeight: 445.82161

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(NC1=C2C=C(C=CC2=O)Cl)C(=O)C3=CC=NC=C3)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C\1C(N(N/C1=C/2\C=C(C=CC2=O)Cl)C(=O)C3=CC=NC=C3)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H15ClF3N3O2/c23-16-5-6-20(30)17(11-16)18-12-19(13-1-3-15(4-2-13)22(24,25)26)29(28-18)21(31)14-7-9-27-10-8-14/h1-11,19,28H,12H2/b18-17+