[1-[4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl]carbonyloxy-2-phenyl-ethyl]azanium chloride

Systemtic Name: [1-[4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl]carbonyloxy-2-phenyl-ethyl]azanium chloride Openeye Name: [1-[4-oxo-3-phenoxy-2-(trifluoromethyl)chromene-7-carbonyl]oxy-2-phenyl-ethyl]ammonium chloride CAS Name: [1-[oxo-[4-oxo-3-phenoxy-2-(trifluoromethyl)-1-benzopyran-7-yl]methoxy]-2-phenylethyl]ammonium chloride IUPAC Name: [1-[4-oxo-3-phenoxy-2-(trifluoromethyl)chromene-7-carbonyl]oxy-2-phenylethyl]azanium chloride Traditional Name: [1-[4-keto-3-phenoxy-2-(trifluoromethyl)chromene-7-carbonyl]oxy-2-phenyl-ethyl]ammonium chloride Formula: C25H19ClF3NO5 MolecularWeight: 505.87027

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC([NH3+])OC(=O)C2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)CC([NH3+])OC(=O)C2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C25H18F3NO5.ClH/c26-25(27,28)23-22(32-17-9-5-2-6-10-17)21(30)18-12-11-16(14-19(18)33-23)24(31)34-20(29)13-15-7-3-1-4-8-15;/h1-12,14,20H,13,29H2;1H