propyl 4-[4-oxidanylidene-7-propanoyloxy-2-(trifluoromethyl)chromen-3-yl]oxybenzoate

Systemtic Name: propyl 4-[4-oxidanylidene-7-propanoyloxy-2-(trifluoromethyl)chromen-3-yl]oxybenzoate Openeye Name: propyl 4-[4-oxo-7-propanoyloxy-2-(trifluoromethyl)chromen-3-yl]oxybenzoate CAS Name: 4-[[4-oxo-7-(1-oxopropoxy)-2-(trifluoromethyl)-1-benzopyran-3-yl]oxy]benzoic acid propyl ester IUPAC Name: propyl 4-[4-oxo-7-propanoyloxy-2-(trifluoromethyl)chromen-3-yl]oxybenzoate Traditional Name: 4-[4-keto-7-propionyloxy-2-(trifluoromethyl)chromen-3-yl]oxybenzoic acid propyl ester Formula: C23H19F3O7 MolecularWeight: 464.38797

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)CC)C(F)(F)F

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)CC)C(F)(F)F

InChI

InChI=1S/C23H19F3O7/c1-3-11-30-22(29)13-5-7-14(8-6-13)32-20-19(28)16-10-9-15(31-18(27)4-2)12-17(16)33-21(20)23(24,25)26/h5-10,12H,3-4,11H2,1-2H3