[4-oxidanidyl-1-oxidanylidene-3,6-bis(trifluoromethyl)quinoxalin-1-ium-2-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-oxidanidyl-1-oxidanylidene-3,6-bis(trifluoromethyl)quinoxalin-1-ium-2-yl]-thiophen-2-yl-methanone Openeye Name: [4-oxido-1-oxo-3,6-bis(trifluoromethyl)quinoxalin-1-ium-2-yl]-(2-thienyl)methanone CAS Name: [4-oxido-1-oxo-3,6-bis(trifluoromethyl)-2-quinoxalin-1-iumyl]-thiophen-2-ylmethanone IUPAC Name: [4-oxido-1-oxo-3,6-bis(trifluoromethyl)quinoxalin-1-ium-2-yl]-thiophen-2-ylmethanone Traditional Name: [1-keto-4-oxido-3,6-bis(trifluoromethyl)quinoxalin-1-ium-2-yl]-(2-thienyl)methanone Formula: C15H6F6N2O3S MolecularWeight: 408.275159

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)C2=C(N(C3=C([N+]2=O)C=CC(=C3)C(F)(F)F)[O-])C(F)(F)F

Isomeric SMILES

C1=CSC(=C1)C(=O)C2=C(N(C3=C([N+]2=O)C=CC(=C3)C(F)(F)F)[O-])C(F)(F)F

InChI

InChI=1S/C15H6F6N2O3S/c16-14(17,18)7-3-4-8-9(6-7)23(26)13(15(19,20)21)11(22(8)25)12(24)10-2-1-5-27-10/h1-6H