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

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

CCCC1(COC(OC1)(CC2=NC=NN2)C3=CC4=CC=CC=C4O3)C

Isomeric SMILES

CCCC1(COC(OC1)(CC2=NC=NN2)C3=CC4=CC=CC=C4O3)C

InChI

InChI=1S/C19H23N3O3/c1-3-8-18(2)11-23-19(24-12-18,10-17-20-13-21-22-17)16-9-14-6-4-5-7-15(14)25-16/h4-7,9,13H,3,8,10-12H2,1-2H3,(H,20,21,22)