8-(1,3-oxazinan-3-ium-3-ylmethyl)-7-oxidanyl-3-phenyl-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 8-(1,3-oxazinan-3-ium-3-ylmethyl)-7-oxidanyl-3-phenyl-2-(trifluoromethyl)chromen-4-one Openeye Name: 7-hydroxy-8-(1,3-oxazinan-3-ium-3-ylmethyl)-3-phenyl-2-(trifluoromethyl)chromen-4-one CAS Name: 7-hydroxy-8-(1,3-oxazinan-3-ium-3-ylmethyl)-3-phenyl-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 7-hydroxy-8-(1,3-oxazinan-3-ium-3-ylmethyl)-3-phenyl-2-(trifluoromethyl)chromen-4-one Traditional Name: 7-hydroxy-8-(1,3-oxazinan-3-ium-3-ylmethyl)-3-phenyl-2-(trifluoromethyl)chromone Formula: C21H19F3NO4+ MolecularWeight: 406.37507

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](COC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=CC=C4)C(F)(F)F)O

Isomeric SMILES

C1C[NH+](COC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=CC=C4)C(F)(F)F)O

InChI

InChI=1S/C21H18F3NO4/c22-21(23,24)20-17(13-5-2-1-3-6-13)18(27)14-7-8-16(26)15(19(14)29-20)11-25-9-4-10-28-12-25/h1-3,5-8,26H,4,9-12H2/p+1