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

Systemtic Name: 9-cyclopropyl-3-phenyl-2-(trifluoromethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Openeye Name: 9-cyclopropyl-3-phenyl-2-(trifluoromethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one CAS Name: 9-cyclopropyl-3-phenyl-2-(trifluoromethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one IUPAC Name: 9-cyclopropyl-3-phenyl-2-(trifluoromethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Traditional Name: 9-cyclopropyl-3-phenyl-2-(trifluoromethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Formula: C21H17F3NO3+ MolecularWeight: 388.35979

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+]2CC3=C(C=CC4=C3OC(=C(C4=O)C5=CC=CC=C5)C(F)(F)F)OC2

Isomeric SMILES

C1CC1[NH+]2CC3=C(C=CC4=C3OC(=C(C4=O)C5=CC=CC=C5)C(F)(F)F)OC2

InChI

InChI=1S/C21H16F3NO3/c22-21(23,24)20-17(12-4-2-1-3-5-12)18(26)14-8-9-16-15(19(14)28-20)10-25(11-27-16)13-6-7-13/h1-5,8-9,13H,6-7,10-11H2/p+1