6-oxidanidyl-5-phenyl-2,2-dipropyl-8-(trifluoromethyl)-1,3-dihydropyrimido[1,2-a]quinoxalin-6-ium

Systemtic Name: 6-oxidanidyl-5-phenyl-2,2-dipropyl-8-(trifluoromethyl)-1,3-dihydropyrimido[1,2-a]quinoxalin-6-ium Openeye Name: 6-oxido-5-phenyl-2,2-dipropyl-8-(trifluoromethyl)-1,3-dihydropyrimido[1,2-a]quinoxalin-6-ium CAS Name: 6-oxido-5-phenyl-2,2-dipropyl-8-(trifluoromethyl)-1,3-dihydropyrimido[1,2-a]quinoxalin-6-ium IUPAC Name: 6-oxido-5-phenyl-2,2-dipropyl-8-(trifluoromethyl)-1,3-dihydropyrimido[1,2-a]quinoxalin-6-ium Traditional Name: 6-oxido-5-phenyl-2,2-dipropyl-8-(trifluoromethyl)-1,3-dihydropyrimido[1,2-a]quinoxalin-6-ium Formula: C24H26F3N3O MolecularWeight: 429.47795

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CN=C2C(=[N+](C3=C(N2C1)C=CC(=C3)C(F)(F)F)[O-])C4=CC=CC=C4)CCC

Isomeric SMILES

CCCC1(CN=C2C(=[N+](C3=C(N2C1)C=CC(=C3)C(F)(F)F)[O-])C4=CC=CC=C4)CCC

InChI

InChI=1S/C24H26F3N3O/c1-3-12-23(13-4-2)15-28-22-21(17-8-6-5-7-9-17)30(31)20-14-18(24(25,26)27)10-11-19(20)29(22)16-23/h5-11,14H,3-4,12-13,15-16H2,1-2H3