3-[[4-(chloromethyl)-2,6-dimethyl-cyclohexyl]methyl]-5-methyl-1H-1,2,4-triazole

Systemtic Name: 3-[[4-(chloromethyl)-2,6-dimethyl-cyclohexyl]methyl]-5-methyl-1H-1,2,4-triazole Openeye Name: 3-[[4-(chloromethyl)-2,6-dimethyl-cyclohexyl]methyl]-5-methyl-1H-1,2,4-triazole CAS Name: 3-[[4-(chloromethyl)-2,6-dimethylcyclohexyl]methyl]-5-methyl-1H-1,2,4-triazole IUPAC Name: 3-[[4-(chloromethyl)-2,6-dimethylcyclohexyl]methyl]-5-methyl-1H-1,2,4-triazole Traditional Name: 3-[[4-(chloromethyl)-2,6-dimethyl-cyclohexyl]methyl]-5-methyl-1H-1,2,4-triazole Formula: C13H22ClN3 MolecularWeight: 255.78688

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1CC2=NNC(=N2)C)C)CCl

Isomeric SMILES

CC1CC(CC(C1CC2=NNC(=N2)C)C)CCl

InChI

InChI=1S/C13H22ClN3/c1-8-4-11(7-14)5-9(2)12(8)6-13-15-10(3)16-17-13/h8-9,11-12H,4-7H2,1-3H3,(H,15,16,17)