4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-5-(4-methoxyphenyl)cyclohexane-1,3-dione

Systemtic Name: 4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-5-(4-methoxyphenyl)cyclohexane-1,3-dione Openeye Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-5-(4-methoxyphenyl)cyclohexane-1,3-dione CAS Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(4-methoxyphenyl)cyclohexane-1,3-dione IUPAC Name: 4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-5-(4-methoxyphenyl)cyclohexane-1,3-dione Traditional Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-5-(4-methoxyphenyl)cyclohexane-1,3-quinone Formula: C19H15ClF3NO3 MolecularWeight: 397.77551

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=O)CC(=O)C2C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(=O)CC(=O)C2C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C19H15ClF3NO3/c1-27-13-4-2-10(3-5-13)14-7-12(25)8-16(26)17(14)18-15(20)6-11(9-24-18)19(21,22)23/h2-6,9,14,17H,7-8H2,1H3