3-[[6-chloranyl-2-oxidanylidene-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]oxy]propanenitrile

Systemtic Name: 3-[[6-chloranyl-2-oxidanylidene-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]oxy]propanenitrile Openeye Name: 3-[[6-chloro-2-oxo-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]oxy]propanenitrile CAS Name: 3-[[6-chloro-2-oxo-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]oxy]propanenitrile IUPAC Name: 3-[[6-chloro-2-oxo-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]oxy]propanenitrile Traditional Name: 3-[[6-chloro-2-keto-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]oxy]propionitrile Formula: C12H8ClF3N2O3 MolecularWeight: 320.65173

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(OC(=O)N2)(C(F)(F)F)OCCC#N

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(OC(=O)N2)(C(F)(F)F)OCCC#N

InChI

InChI=1S/C12H8ClF3N2O3/c13-7-2-3-9-8(6-7)11(12(14,15)16,20-5-1-4-17)21-10(19)18-9/h2-3,6H,1,5H2,(H,18,19)