3-(1,3-benzodioxol-5-yl)-6-ethyl-7-oxidanyl-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-6-ethyl-7-oxidanyl-2-(trifluoromethyl)chromen-4-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-6-ethyl-7-hydroxy-2-(trifluoromethyl)chromen-4-one CAS Name: 3-(1,3-benzodioxol-5-yl)-6-ethyl-7-hydroxy-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-6-ethyl-7-hydroxy-2-(trifluoromethyl)chromen-4-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-6-ethyl-7-hydroxy-2-(trifluoromethyl)chromone Formula: C19H13F3O5 MolecularWeight: 378.29873

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC4=C(C=C3)OCO4)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC4=C(C=C3)OCO4)O

InChI

InChI=1S/C19H13F3O5/c1-2-9-5-11-14(7-12(9)23)27-18(19(20,21)22)16(17(11)24)10-3-4-13-15(6-10)26-8-25-13/h3-7,23H,2,8H2,1H3