3-phenyl-9-propan-2-yl-2-(trifluoromethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one

Systemtic Name: 3-phenyl-9-propan-2-yl-2-(trifluoromethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Openeye Name: 9-isopropyl-3-phenyl-2-(trifluoromethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one CAS Name: 3-phenyl-9-propan-2-yl-2-(trifluoromethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one IUPAC Name: 3-phenyl-9-propan-2-yl-2-(trifluoromethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Traditional Name: 9-isopropyl-3-phenyl-2-(trifluoromethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Formula: C21H19F3NO3+ MolecularWeight: 390.37567

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=CC=C4)C(F)(F)F)OC1

Isomeric SMILES

CC(C)[NH+]1CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=CC=C4)C(F)(F)F)OC1

InChI

InChI=1S/C21H18F3NO3/c1-12(2)25-10-15-16(27-11-25)9-8-14-18(26)17(13-6-4-3-5-7-13)20(21(22,23)24)28-19(14)15/h3-9,12H,10-11H2,1-2H3/p+1