1-[5-(4-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]heptan-1-one

Systemtic Name: 1-[5-(4-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]heptan-1-one Openeye Name: 1-[5-(4-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]heptan-1-one CAS Name: 1-[5-(4-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]-1-heptanone IUPAC Name: 1-[5-(4-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]heptan-1-one Traditional Name: 1-[5-(4-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]heptan-1-one Formula: C18H24ClN3O2 MolecularWeight: 349.85506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N1C(=NC(=N1)OCCC)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCC(=O)N1C(=NC(=N1)OCCC)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H24ClN3O2/c1-3-5-6-7-8-16(23)22-17(14-9-11-15(19)12-10-14)20-18(21-22)24-13-4-2/h9-12H,3-8,13H2,1-2H3