(phenylmethyl) (2E)-3-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-oxidanylidene-2-(1H-pyridin-2-ylidene)propanoate

Systemtic Name: (phenylmethyl) (2E)-3-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-oxidanylidene-2-(1H-pyridin-2-ylidene)propanoate Openeye Name: benzyl (2E)-3-[2-chloro-5-(trifluoromethyl)phenyl]-3-oxo-2-(1H-pyridin-2-ylidene)propanoate CAS Name: (2E)-3-[2-chloro-5-(trifluoromethyl)phenyl]-3-oxo-2-(1H-pyridin-2-ylidene)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2E)-3-[2-chloro-5-(trifluoromethyl)phenyl]-3-oxo-2-(1H-pyridin-2-ylidene)propanoate Traditional Name: (2E)-3-[2-chloro-5-(trifluoromethyl)phenyl]-3-keto-2-(1H-pyridin-2-ylidene)propionic acid benzyl ester Formula: C22H15ClF3NO3 MolecularWeight: 433.80761

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(=C2C=CC=CN2)C(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)/C(=C/2\C=CC=CN2)/C(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C22H15ClF3NO3/c23-17-10-9-15(22(24,25)26)12-16(17)20(28)19(18-8-4-5-11-27-18)21(29)30-13-14-6-2-1-3-7-14/h1-12,27H,13H2/b19-18+