1-[[2-(4-methylphenyl)-1,3-dioxan-2-yl]methyl]-1,2,4-triazole

Systemtic Name: 1-[[2-(4-methylphenyl)-1,3-dioxan-2-yl]methyl]-1,2,4-triazole Openeye Name: 1-[[2-(p-tolyl)-1,3-dioxan-2-yl]methyl]-1,2,4-triazole CAS Name: 1-[[2-(4-methylphenyl)-1,3-dioxan-2-yl]methyl]-1,2,4-triazole IUPAC Name: 1-[[2-(4-methylphenyl)-1,3-dioxan-2-yl]methyl]-1,2,4-triazole Traditional Name: 1-[[2-(p-tolyl)-1,3-dioxan-2-yl]methyl]-1,2,4-triazole Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(OCCCO2)CN3C=NC=N3

Isomeric SMILES

CC1=CC=C(C=C1)C2(OCCCO2)CN3C=NC=N3

InChI

InChI=1S/C14H17N3O2/c1-12-3-5-13(6-4-12)14(18-7-2-8-19-14)9-17-11-15-10-16-17/h3-6,10-11H,2,7-9H2,1H3