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

Systemtic Name: 1-[5-(3-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]-2-ethyl-hexan-1-one Openeye Name: 1-[5-(3-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]-2-ethyl-hexan-1-one CAS Name: 1-[5-(3-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]-2-ethyl-1-hexanone IUPAC Name: 1-[5-(3-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]-2-ethylhexan-1-one Traditional Name: 1-[5-(3-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]-2-ethyl-hexan-1-one Formula: C19H26ClN3O2 MolecularWeight: 363.88164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26ClN3O2/c1-4-7-9-14(6-3)18(24)23-17(15-10-8-11-16(20)13-15)21-19(22-23)25-12-5-2/h8,10-11,13-14H,4-7,9,12H2,1-3H3