7-chloranyl-1-oxidanidyl-4-oxidanylidene-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoxalin-4-ium-2-carbonitrile

Systemtic Name: 7-chloranyl-1-oxidanidyl-4-oxidanylidene-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoxalin-4-ium-2-carbonitrile Openeye Name: 7-chloro-1-oxido-4-oxo-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoxalin-4-ium-2-carbonitrile CAS Name: 7-chloro-1-oxido-4-oxo-3-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-2-quinoxalin-4-iumcarbonitrile IUPAC Name: 7-chloro-1-oxido-4-oxo-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoxalin-4-ium-2-carbonitrile Traditional Name: 7-chloro-4-keto-1-oxido-3-[4-[3-(trifluoromethyl)phenyl]piperazino]quinoxalin-4-ium-2-carbonitrile Formula: C20H15ClF3N5O2 MolecularWeight: 449.81361

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C3=C(N(C4=C([N+]3=O)C=CC(=C4)Cl)[O-])C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C3=C(N(C4=C([N+]3=O)C=CC(=C4)Cl)[O-])C#N

InChI

InChI=1S/C20H15ClF3N5O2/c21-14-4-5-16-17(11-14)28(30)18(12-25)19(29(16)31)27-8-6-26(7-9-27)15-3-1-2-13(10-15)20(22,23)24/h1-5,10-11H,6-9H2