3-chloranyl-5-[2-fluoranyl-6-methoxy-3-[(4-methyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzenecarbonitrile

Systemtic Name: 3-chloranyl-5-[2-fluoranyl-6-methoxy-3-[(4-methyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzenecarbonitrile Openeye Name: 3-chloro-5-[2-fluoro-6-methoxy-3-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzonitrile CAS Name: 3-chloro-5-[2-fluoro-6-methoxy-3-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzonitrile IUPAC Name: 3-chloro-5-[2-fluoro-6-methoxy-3-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzonitrile Traditional Name: 3-chloro-5-[2-fluoro-3-[(5-keto-4-methyl-1H-1,2,4-triazol-3-yl)methyl]-6-methoxy-phenoxy]benzonitrile Formula: C18H14ClFN4O3 MolecularWeight: 388.780163

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=O)CC2=C(C(=C(C=C2)OC)OC3=CC(=CC(=C3)C#N)Cl)F

Isomeric SMILES

CN1C(=NNC1=O)CC2=C(C(=C(C=C2)OC)OC3=CC(=CC(=C3)C#N)Cl)F

InChI

InChI=1S/C18H14ClFN4O3/c1-24-15(22-23-18(24)25)7-11-3-4-14(26-2)17(16(11)20)27-13-6-10(9-21)5-12(19)8-13/h3-6,8H,7H2,1-2H3,(H,23,25)