1-[[2-(3-bromanyl-4-methyl-phenyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole

Systemtic Name: 1-[[2-(3-bromanyl-4-methyl-phenyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole Openeye Name: 1-[[2-(3-bromo-4-methyl-phenyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole CAS Name: 1-[[2-(3-bromo-4-methylphenyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole IUPAC Name: 1-[[2-(3-bromo-4-methylphenyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole Traditional Name: 1-[[2-(3-bromo-4-methyl-phenyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole Formula: C13H14BrN3O2 MolecularWeight: 324.17316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2(OCCO2)CN3C=NC=N3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C2(OCCO2)CN3C=NC=N3)Br

InChI

InChI=1S/C13H14BrN3O2/c1-10-2-3-11(6-12(10)14)13(18-4-5-19-13)7-17-9-15-8-16-17/h2-3,6,8-9H,4-5,7H2,1H3