3-[5-(hydroxymethyl)-3,3-dimethyl-2H-1-benzofuran-7-yl]-4-(trifluoromethyloxy)benzaldehyde

Systemtic Name: 3-[5-(hydroxymethyl)-3,3-dimethyl-2H-1-benzofuran-7-yl]-4-(trifluoromethyloxy)benzaldehyde Openeye Name: 3-[5-(hydroxymethyl)-3,3-dimethyl-2H-benzofuran-7-yl]-4-(trifluoromethoxy)benzaldehyde CAS Name: 3-[5-(hydroxymethyl)-3,3-dimethyl-2H-benzofuran-7-yl]-4-(trifluoromethoxy)benzaldehyde IUPAC Name: 3-[5-(hydroxymethyl)-3,3-dimethyl-2H-1-benzofuran-7-yl]-4-(trifluoromethoxy)benzaldehyde Traditional Name: 3-(3,3-dimethyl-5-methylol-coumaran-7-yl)-4-(trifluoromethoxy)benzaldehyde Formula: C19H17F3O4 MolecularWeight: 366.33109

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C1C=C(C=C2C3=C(C=CC(=C3)C=O)OC(F)(F)F)CO)C

Isomeric SMILES

CC1(COC2=C1C=C(C=C2C3=C(C=CC(=C3)C=O)OC(F)(F)F)CO)C

InChI

InChI=1S/C19H17F3O4/c1-18(2)10-25-17-14(6-12(9-24)7-15(17)18)13-5-11(8-23)3-4-16(13)26-19(20,21)22/h3-8,24H,9-10H2,1-2H3