7-methyl-10-[[3-(trifluoromethyl)phenyl]methyl]-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one

Systemtic Name: 7-methyl-10-[[3-(trifluoromethyl)phenyl]methyl]-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one Openeye Name: 7-methyl-10-[[3-(trifluoromethyl)phenyl]methyl]-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one CAS Name: 7-methyl-10-[[3-(trifluoromethyl)phenyl]methyl]-10,11-dihydro-9H-[2]benzopyrano[4,3-g][1,3]benzoxazin-10-ium-5-one IUPAC Name: 7-methyl-10-[[3-(trifluoromethyl)phenyl]methyl]-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one Traditional Name: 7-methyl-10-[3-(trifluoromethyl)benzyl]-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one Formula: C24H19F3NO3+ MolecularWeight: 426.40777

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC3=C1OC[NH+](C3)CC4=CC(=CC=C4)C(F)(F)F)C5=CC=CC=C5C(=O)O2

Isomeric SMILES

CC1=C2C(=CC3=C1OC[NH+](C3)CC4=CC(=CC=C4)C(F)(F)F)C5=CC=CC=C5C(=O)O2

InChI

InChI=1S/C24H18F3NO3/c1-14-21-16(10-20-18-7-2-3-8-19(18)23(29)31-22(14)20)12-28(13-30-21)11-15-5-4-6-17(9-15)24(25,26)27/h2-10H,11-13H2,1H3/p+1