(2Z)-3-azanyl-3-morpholin-4-ium-4-ylidene-2-[[3-(trifluoromethyl)phenyl]hydrazinylidene]propanenitrile

Systemtic Name: (2Z)-3-azanyl-3-morpholin-4-ium-4-ylidene-2-[[3-(trifluoromethyl)phenyl]hydrazinylidene]propanenitrile Openeye Name: (1Z)-2-amino-2-morpholin-4-ium-4-ylidene-N-[3-(trifluoromethyl)anilino]acetimidoyl cyanide CAS Name: (2Z)-3-amino-3-(4-morpholin-4-iumylidene)-2-[[3-(trifluoromethyl)phenyl]hydrazinylidene]propanenitrile IUPAC Name: (1Z)-2-amino-2-morpholin-4-ium-4-ylidene-N-[3-(trifluoromethyl)anilino]ethanimidoyl cyanide Traditional Name: (2Z)-3-amino-3-morpholin-4-ium-4-ylidene-2-[[3-(trifluoromethyl)phenyl]hydrazono]propionitrile Formula: C14H15F3N5O+ MolecularWeight: 326.29701

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[N+]1=C(C(=NNC2=CC=CC(=C2)C(F)(F)F)C#N)N

Isomeric SMILES

C1COCC[N+]1=C(/C(=N\NC2=CC=CC(=C2)C(F)(F)F)/C#N)N

InChI

InChI=1S/C14H14F3N5O/c15-14(16,17)10-2-1-3-11(8-10)20-21-12(9-18)13(19)22-4-6-23-7-5-22/h1-3,8H,4-7H2,(H2,19,20)/p+1