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

Systemtic Name: 1-[[2-(1-benzofuran-2-yl)-5-ethyl-4-propyl-1,3-dioxan-2-yl]methyl]-1,2,4-triazole Openeye Name: 1-[[2-(benzofuran-2-yl)-5-ethyl-4-propyl-1,3-dioxan-2-yl]methyl]-1,2,4-triazole CAS Name: 1-[[2-(2-benzofuranyl)-5-ethyl-4-propyl-1,3-dioxan-2-yl]methyl]-1,2,4-triazole IUPAC Name: 1-[[2-(1-benzofuran-2-yl)-5-ethyl-4-propyl-1,3-dioxan-2-yl]methyl]-1,2,4-triazole Traditional Name: 1-[[2-(benzofuran-2-yl)-5-ethyl-4-propyl-1,3-dioxan-2-yl]methyl]-1,2,4-triazole Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(COC(O1)(CN2C=NC=N2)C3=CC4=CC=CC=C4O3)CC

Isomeric SMILES

CCCC1C(COC(O1)(CN2C=NC=N2)C3=CC4=CC=CC=C4O3)CC

InChI

InChI=1S/C20H25N3O3/c1-3-7-18-15(4-2)11-24-20(26-18,12-23-14-21-13-22-23)19-10-16-8-5-6-9-17(16)25-19/h5-6,8-10,13-15,18H,3-4,7,11-12H2,1-2H3