4-(oxan-4-ylamino)-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-(oxan-4-ylamino)-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-(tetrahydropyran-4-ylamino)-2-(trifluoromethyl)benzonitrile CAS Name: 4-(4-oxanylamino)-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-(oxan-4-ylamino)-2-(trifluoromethyl)benzonitrile Traditional Name: 4-(tetrahydropyran-4-ylamino)-2-(trifluoromethyl)benzonitrile Formula: C13H13F3N2O MolecularWeight: 270.25033

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NC2=CC(=C(C=C2)C#N)C(F)(F)F

Isomeric SMILES

C1COCCC1NC2=CC(=C(C=C2)C#N)C(F)(F)F

InChI

InChI=1S/C13H13F3N2O/c14-13(15,16)12-7-11(2-1-9(12)8-17)18-10-3-5-19-6-4-10/h1-2,7,10,18H,3-6H2