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

Systemtic Name: 1-[[2-(4-bromanyl-2-methyl-phenyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole Openeye Name: 1-[[2-(4-bromo-2-methyl-phenyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole CAS Name: 1-[[2-(4-bromo-2-methylphenyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole IUPAC Name: 1-[[2-(4-bromo-2-methylphenyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole Traditional Name: 1-[[2-(4-bromo-2-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=CC(=C1)Br)C2(OCCO2)CN3C=NC=N3

Isomeric SMILES

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

InChI

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