4-chloranyl-3-(2-fluoranyl-4-isocyano-5-phenoxy-phenyl)-1-methyl-5-(trifluoromethyl)pyrazole

Systemtic Name: 4-chloranyl-3-(2-fluoranyl-4-isocyano-5-phenoxy-phenyl)-1-methyl-5-(trifluoromethyl)pyrazole Openeye Name: 4-chloro-3-(2-fluoro-4-isocyano-5-phenoxy-phenyl)-1-methyl-5-(trifluoromethyl)pyrazole CAS Name: 4-chloro-3-(2-fluoro-4-isocyano-5-phenoxyphenyl)-1-methyl-5-(trifluoromethyl)pyrazole IUPAC Name: 4-chloro-3-(2-fluoro-4-isocyano-5-phenoxyphenyl)-1-methyl-5-(trifluoromethyl)pyrazole Traditional Name: 4-chloro-3-(2-fluoro-4-isocyano-5-phenoxy-phenyl)-1-methyl-5-(trifluoromethyl)pyrazole Formula: C18H10ClF4N3O MolecularWeight: 395.738113

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC(=C(C=C2F)[N+]#[C-])OC3=CC=CC=C3)Cl)C(F)(F)F

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC(=C(C=C2F)[N+]#[C-])OC3=CC=CC=C3)Cl)C(F)(F)F

InChI

InChI=1S/C18H10ClF4N3O/c1-24-13-9-12(20)11(8-14(13)27-10-6-4-3-5-7-10)16-15(19)17(18(21,22)23)26(2)25-16/h3-9H,2H3