[6-ethyl-4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 3,4,5-trimethoxybenzoate

Systemtic Name: [6-ethyl-4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 3,4,5-trimethoxybenzoate Openeye Name: [6-ethyl-4-oxo-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [6-ethyl-4-oxo-3-phenoxy-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [6-ethyl-4-oxo-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [6-ethyl-4-keto-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] ester Formula: C28H23F3O8 MolecularWeight: 544.47263

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=CC=C3)OC(=O)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=CC=C3)OC(=O)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C28H23F3O8/c1-5-15-11-18-20(38-26(28(29,30)31)25(23(18)32)37-17-9-7-6-8-10-17)14-19(15)39-27(33)16-12-21(34-2)24(36-4)22(13-16)35-3/h6-14H,5H2,1-4H3