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

Systemtic Name: 5-[[2-(5-chloranyl-1-benzofuran-2-yl)-1,3-dioxan-2-yl]methyl]-1H-1,2,4-triazole Openeye Name: 5-[[2-(5-chlorobenzofuran-2-yl)-1,3-dioxan-2-yl]methyl]-1H-1,2,4-triazole CAS Name: 5-[[2-(5-chloro-2-benzofuranyl)-1,3-dioxan-2-yl]methyl]-1H-1,2,4-triazole IUPAC Name: 5-[[2-(5-chloro-1-benzofuran-2-yl)-1,3-dioxan-2-yl]methyl]-1H-1,2,4-triazole Traditional Name: 5-[[2-(5-chlorobenzofuran-2-yl)-1,3-dioxan-2-yl]methyl]-1H-1,2,4-triazole Formula: C15H14ClN3O3 MolecularWeight: 319.74296

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(OC1)(CC2=NC=NN2)C3=CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1COC(OC1)(CC2=NC=NN2)C3=CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C15H14ClN3O3/c16-11-2-3-12-10(6-11)7-13(22-12)15(20-4-1-5-21-15)8-14-17-9-18-19-14/h2-3,6-7,9H,1,4-5,8H2,(H,17,18,19)