8-methyl-3-[2,3,5,6-tetrakis(trifluoromethyl)phenyl]-2H-1,3-benzoxazin-3-ium

Systemtic Name: 8-methyl-3-[2,3,5,6-tetrakis(trifluoromethyl)phenyl]-2H-1,3-benzoxazin-3-ium Openeye Name: 8-methyl-3-[2,3,5,6-tetrakis(trifluoromethyl)phenyl]-2H-1,3-benzoxazin-3-ium CAS Name: 8-methyl-3-[2,3,5,6-tetrakis(trifluoromethyl)phenyl]-2H-1,3-benzoxazin-3-ium IUPAC Name: 8-methyl-3-[2,3,5,6-tetrakis(trifluoromethyl)phenyl]-2H-1,3-benzoxazin-3-ium Traditional Name: 8-methyl-3-[2,3,5,6-tetrakis(trifluoromethyl)phenyl]-2H-1,3-benzoxazin-3-ium Formula: C19H10F12NO+ MolecularWeight: 496.269638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OC[N+](=C2)C3=C(C(=CC(=C3C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=CC=CC2=C1OC[N+](=C2)C3=C(C(=CC(=C3C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C19H10F12NO/c1-8-3-2-4-9-6-32(7-33-15(8)9)14-12(18(26,27)28)10(16(20,21)22)5-11(17(23,24)25)13(14)19(29,30)31/h2-6H,7H2,1H3/q+1