1-[2-(4-chlorophenyl)-2-heptoxy-ethyl]-1,2,4-triazole

Systemtic Name: 1-[2-(4-chlorophenyl)-2-heptoxy-ethyl]-1,2,4-triazole Openeye Name: 1-[2-(4-chlorophenyl)-2-heptoxy-ethyl]-1,2,4-triazole CAS Name: 1-[2-(4-chlorophenyl)-2-heptoxyethyl]-1,2,4-triazole IUPAC Name: 1-[2-(4-chlorophenyl)-2-heptoxyethyl]-1,2,4-triazole Traditional Name: 1-[2-(4-chlorophenyl)-2-heptoxy-ethyl]-1,2,4-triazole Formula: C17H24ClN3O MolecularWeight: 321.84496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24ClN3O/c1-2-3-4-5-6-11-22-17(12-21-14-19-13-20-21)15-7-9-16(18)10-8-15/h7-10,13-14,17H,2-6,11-12H2,1H3