3-(2-diethylaminoethylimino)-1-oxidanidyl-4-oxidanyl-7-(trifluoromethyl)quinoxalin-1-ium-2-carbonitrile

Systemtic Name: 3-(2-diethylaminoethylimino)-1-oxidanidyl-4-oxidanyl-7-(trifluoromethyl)quinoxalin-1-ium-2-carbonitrile Openeye Name: 3-(2-diethylaminoethylimino)-4-hydroxy-1-oxido-7-(trifluoromethyl)quinoxalin-1-ium-2-carbonitrile CAS Name: 3-(2-diethylaminoethylimino)-4-hydroxy-1-oxido-7-(trifluoromethyl)-2-quinoxalin-1-iumcarbonitrile IUPAC Name: 3-(2-diethylaminoethylimino)-4-hydroxy-1-oxido-7-(trifluoromethyl)quinoxalin-1-ium-2-carbonitrile Traditional Name: 3-(2-diethylaminoethylimino)-4-hydroxy-1-oxido-7-(trifluoromethyl)quinoxalin-1-ium-2-carbonitrile Formula: C16H18F3N5O2 MolecularWeight: 369.34163

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN=C1C(=[N+](C2=C(N1O)C=CC(=C2)C(F)(F)F)[O-])C#N

Isomeric SMILES

CCN(CC)CCN=C1C(=[N+](C2=C(N1O)C=CC(=C2)C(F)(F)F)[O-])C#N

InChI

InChI=1S/C16H18F3N5O2/c1-3-22(4-2)8-7-21-15-14(10-20)23(25)13-9-11(16(17,18)19)5-6-12(13)24(15)26/h5-6,9,26H,3-4,7-8H2,1-2H3