1-(4-methylphenyl)-6-oxidanidyl-8-(trifluoromethyl)-3,4-dihydropyrazino[1,2-b]indazol-6-ium

Systemtic Name: 1-(4-methylphenyl)-6-oxidanidyl-8-(trifluoromethyl)-3,4-dihydropyrazino[1,2-b]indazol-6-ium Openeye Name: 6-oxido-1-(p-tolyl)-8-(trifluoromethyl)-3,4-dihydropyrazino[1,2-b]indazol-6-ium CAS Name: 1-(4-methylphenyl)-6-oxido-8-(trifluoromethyl)-3,4-dihydropyrazino[1,2-b]indazol-6-ium IUPAC Name: 1-(4-methylphenyl)-6-oxido-8-(trifluoromethyl)-3,4-dihydropyrazino[1,2-b]indazol-6-ium Traditional Name: 6-oxido-1-(p-tolyl)-8-(trifluoromethyl)-3,4-dihydropyrazin[1,2-b]indazol-6-ium Formula: C18H14F3N3O MolecularWeight: 345.31847

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NCCN3C2=C4C=CC(=CC4=[N+]3[O-])C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=NCCN3C2=C4C=CC(=CC4=[N+]3[O-])C(F)(F)F

InChI

InChI=1S/C18H14F3N3O/c1-11-2-4-12(5-3-11)16-17-14-7-6-13(18(19,20)21)10-15(14)24(25)23(17)9-8-22-16/h2-7,10H,8-9H2,1H3