3-(1-benzofuran-2-yl)-4,5-bis(oxidanyl)-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one

Systemtic Name: 3-(1-benzofuran-2-yl)-4,5-bis(oxidanyl)-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one Openeye Name: 3-(benzofuran-2-yl)-4,5-dihydroxy-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one CAS Name: 3-(2-benzofuranyl)-4,5-dihydroxy-2-(trifluoromethyl)-5,6,8,8a-tetrahydro-1-benzopyran-7-one IUPAC Name: 3-(1-benzofuran-2-yl)-4,5-dihydroxy-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one Traditional Name: 3-(benzofuran-2-yl)-4,5-dihydroxy-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one Formula: C18H13F3O5 MolecularWeight: 366.28803

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C(=C(OC2CC1=O)C(F)(F)F)C3=CC4=CC=CC=C4O3)O)O

Isomeric SMILES

C1C(C2=C(C(=C(OC2CC1=O)C(F)(F)F)C3=CC4=CC=CC=C4O3)O)O

InChI

InChI=1S/C18H13F3O5/c19-18(20,21)17-15(12-5-8-3-1-2-4-11(8)25-12)16(24)14-10(23)6-9(22)7-13(14)26-17/h1-5,10,13,23-24H,6-7H2