5-[bis(fluoranyl)methoxy]-4-chloranyl-3-(2-fluoranyl-4-isocyano-5-phenoxy-phenyl)-1-methyl-pyrazole

Systemtic Name: 5-[bis(fluoranyl)methoxy]-4-chloranyl-3-(2-fluoranyl-4-isocyano-5-phenoxy-phenyl)-1-methyl-pyrazole Openeye Name: 4-chloro-5-(difluoromethoxy)-3-(2-fluoro-4-isocyano-5-phenoxy-phenyl)-1-methyl-pyrazole CAS Name: 4-chloro-5-(difluoromethoxy)-3-(2-fluoro-4-isocyano-5-phenoxyphenyl)-1-methylpyrazole IUPAC Name: 4-chloro-5-(difluoromethoxy)-3-(2-fluoro-4-isocyano-5-phenoxyphenyl)-1-methylpyrazole Traditional Name: 4-chloro-5-(difluoromethoxy)-3-(2-fluoro-4-isocyano-5-phenoxy-phenyl)-1-methyl-pyrazole Formula: C18H11ClF3N3O2 MolecularWeight: 393.74705

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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)OC(F)F

Isomeric SMILES

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

InChI

InChI=1S/C18H11ClF3N3O2/c1-23-13-9-12(20)11(8-14(13)26-10-6-4-3-5-7-10)16-15(19)17(25(2)24-16)27-18(21)22/h3-9,18H,2H3