5-[[2-(1-benzofuran-2-yl)-5,5-diethyl-1,3-dioxan-2-yl]methyl]-1H-1,2,4-triazole

Systemtic Name: 5-[[2-(1-benzofuran-2-yl)-5,5-diethyl-1,3-dioxan-2-yl]methyl]-1H-1,2,4-triazole Openeye Name: 5-[[2-(benzofuran-2-yl)-5,5-diethyl-1,3-dioxan-2-yl]methyl]-1H-1,2,4-triazole CAS Name: 5-[[2-(2-benzofuranyl)-5,5-diethyl-1,3-dioxan-2-yl]methyl]-1H-1,2,4-triazole IUPAC Name: 5-[[2-(1-benzofuran-2-yl)-5,5-diethyl-1,3-dioxan-2-yl]methyl]-1H-1,2,4-triazole Traditional Name: 5-[[2-(benzofuran-2-yl)-5,5-diethyl-1,3-dioxan-2-yl]methyl]-1H-1,2,4-triazole Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(COC(OC1)(CC2=NC=NN2)C3=CC4=CC=CC=C4O3)CC

Isomeric SMILES

CCC1(COC(OC1)(CC2=NC=NN2)C3=CC4=CC=CC=C4O3)CC

InChI

InChI=1S/C19H23N3O3/c1-3-18(4-2)11-23-19(24-12-18,10-17-20-13-21-22-17)16-9-14-7-5-6-8-15(14)25-16/h5-9,13H,3-4,10-12H2,1-2H3,(H,20,21,22)