1-[5-(2-chlorophenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]butan-1-one

Systemtic Name: 1-[5-(2-chlorophenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]butan-1-one Openeye Name: 1-[5-(2-chlorophenyl)-3-isobutoxy-1,2,4-triazol-1-yl]butan-1-one CAS Name: 1-[5-(2-chlorophenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-1-butanone IUPAC Name: 1-[5-(2-chlorophenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]butan-1-one Traditional Name: 1-[5-(2-chlorophenyl)-3-isobutoxy-1,2,4-triazol-1-yl]butan-1-one Formula: C16H20ClN3O2 MolecularWeight: 321.8019

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(=NC(=N1)OCC(C)C)C2=CC=CC=C2Cl

Isomeric SMILES

CCCC(=O)N1C(=NC(=N1)OCC(C)C)C2=CC=CC=C2Cl

InChI

InChI=1S/C16H20ClN3O2/c1-4-7-14(21)20-15(12-8-5-6-9-13(12)17)18-16(19-20)22-10-11(2)3/h5-6,8-9,11H,4,7,10H2,1-3H3