1-[[2-(5-methyl-2-benzofuran-1-yl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole

Systemtic Name: 1-[[2-(5-methyl-2-benzofuran-1-yl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole Openeye Name: 1-[[2-(5-methylisobenzofuran-1-yl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole CAS Name: 1-[[2-(5-methyl-1-isobenzofuranyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole IUPAC Name: 1-[[2-(5-methyl-2-benzofuran-1-yl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole Traditional Name: 1-[[2-(5-methylisobenzofuran-1-yl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole Formula: C15H15N3O3 MolecularWeight: 285.2979

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=COC(=C2C=C1)C3(OCCO3)CN4C=NC=N4

Isomeric SMILES

CC1=CC2=COC(=C2C=C1)C3(OCCO3)CN4C=NC=N4

InChI

InChI=1S/C15H15N3O3/c1-11-2-3-13-12(6-11)7-19-14(13)15(20-4-5-21-15)8-18-10-16-9-17-18/h2-3,6-7,9-10H,4-5,8H2,1H3