1-[2-(4-chlorophenyl)-2-methyl-hexyl]-1,2,4-triazole

Systemtic Name: 1-[2-(4-chlorophenyl)-2-methyl-hexyl]-1,2,4-triazole Openeye Name: 1-[2-(4-chlorophenyl)-2-methyl-hexyl]-1,2,4-triazole CAS Name: 1-[2-(4-chlorophenyl)-2-methylhexyl]-1,2,4-triazole IUPAC Name: 1-[2-(4-chlorophenyl)-2-methylhexyl]-1,2,4-triazole Traditional Name: 1-[2-(4-chlorophenyl)-2-methyl-hexyl]-1,2,4-triazole Formula: C15H20ClN3 MolecularWeight: 277.7924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CN1C=NC=N1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCC(C)(CN1C=NC=N1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H20ClN3/c1-3-4-9-15(2,10-19-12-17-11-18-19)13-5-7-14(16)8-6-13/h5-8,11-12H,3-4,9-10H2,1-2H3