5-[3-azido-1-(1,2-oxazol-3-yl)propyl]-6-oxidanylidene-4-(trifluoromethyl)cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 5-[3-azido-1-(1,2-oxazol-3-yl)propyl]-6-oxidanylidene-4-(trifluoromethyl)cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 5-(3-azido-1-isoxazol-3-yl-propyl)-6-oxo-4-(trifluoromethyl)cyclohexa-1,3-diene-1-carbonitrile CAS Name: 5-[3-azido-1-(3-isoxazolyl)propyl]-6-oxo-4-(trifluoromethyl)-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 5-[3-azido-1-(1,2-oxazol-3-yl)propyl]-6-oxo-4-(trifluoromethyl)cyclohexa-1,3-diene-1-carbonitrile Traditional Name: 5-(3-azido-1-isoxazol-3-yl-propyl)-6-keto-4-(trifluoromethyl)cyclohexa-1,3-diene-1-carbonitrile Formula: C14H10F3N5O2 MolecularWeight: 337.25671

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Descriptors Computed from Structure

Canonical SMILES:

C1=CON=C1C(CCN=[N+]=[N-])C2C(=CC=C(C2=O)C#N)C(F)(F)F

Isomeric SMILES

C1=CON=C1C(CCN=[N+]=[N-])C2C(=CC=C(C2=O)C#N)C(F)(F)F

InChI

InChI=1S/C14H10F3N5O2/c15-14(16,17)10-2-1-8(7-18)13(23)12(10)9(3-5-20-22-19)11-4-6-24-21-11/h1-2,4,6,9,12H,3,5H2