5-[[2-tert-butyl-3-(4-chlorophenyl)oxiran-2-yl]methyl]-1H-1,2,4-triazole

Systemtic Name: 5-[[2-tert-butyl-3-(4-chlorophenyl)oxiran-2-yl]methyl]-1H-1,2,4-triazole Openeye Name: 5-[[2-tert-butyl-3-(4-chlorophenyl)oxiran-2-yl]methyl]-1H-1,2,4-triazole CAS Name: 5-[[2-tert-butyl-3-(4-chlorophenyl)-2-oxiranyl]methyl]-1H-1,2,4-triazole IUPAC Name: 5-[[2-tert-butyl-3-(4-chlorophenyl)oxiran-2-yl]methyl]-1H-1,2,4-triazole Traditional Name: 5-[[2-tert-butyl-3-(4-chlorophenyl)oxiran-2-yl]methyl]-1H-1,2,4-triazole Formula: C15H18ClN3O MolecularWeight: 291.77592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(C(O1)C2=CC=C(C=C2)Cl)CC3=NC=NN3

Isomeric SMILES

CC(C)(C)C1(C(O1)C2=CC=C(C=C2)Cl)CC3=NC=NN3

InChI

InChI=1S/C15H18ClN3O/c1-14(2,3)15(8-12-17-9-18-19-12)13(20-15)10-4-6-11(16)7-5-10/h4-7,9,13H,8H2,1-3H3,(H,17,18,19)