4-chloranyl-5-(2,4-dimethylphenoxy)-2-[5-(trifluoromethyl)pyridin-2-yl]pyridazin-3-one

Systemtic Name: 4-chloranyl-5-(2,4-dimethylphenoxy)-2-[5-(trifluoromethyl)pyridin-2-yl]pyridazin-3-one Openeye Name: 4-chloro-5-(2,4-dimethylphenoxy)-2-[5-(trifluoromethyl)-2-pyridyl]pyridazin-3-one CAS Name: 4-chloro-5-(2,4-dimethylphenoxy)-2-[5-(trifluoromethyl)-2-pyridinyl]-3-pyridazinone IUPAC Name: 4-chloro-5-(2,4-dimethylphenoxy)-2-[5-(trifluoromethyl)pyridin-2-yl]pyridazin-3-one Traditional Name: 4-chloro-5-(2,4-dimethylphenoxy)-2-[5-(trifluoromethyl)-2-pyridyl]pyridazin-3-one Formula: C18H13ClF3N3O2 MolecularWeight: 395.76293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=C(C(=O)N(N=C2)C3=NC=C(C=C3)C(F)(F)F)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=C(C(=O)N(N=C2)C3=NC=C(C=C3)C(F)(F)F)Cl)C

InChI

InChI=1S/C18H13ClF3N3O2/c1-10-3-5-13(11(2)7-10)27-14-9-24-25(17(26)16(14)19)15-6-4-12(8-23-15)18(20,21)22/h3-9H,1-2H3