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

Systemtic Name: 1-[5-(2-chlorophenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-2-phenyl-butan-1-one Openeye Name: 1-[5-(2-chlorophenyl)-3-isobutoxy-1,2,4-triazol-1-yl]-2-phenyl-butan-1-one CAS Name: 1-[5-(2-chlorophenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-2-phenyl-1-butanone IUPAC Name: 1-[5-(2-chlorophenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-2-phenylbutan-1-one Traditional Name: 1-[5-(2-chlorophenyl)-3-isobutoxy-1,2,4-triazol-1-yl]-2-phenyl-butan-1-one Formula: C22H24ClN3O2 MolecularWeight: 397.89786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2C(=NC(=N2)OCC(C)C)C3=CC=CC=C3Cl

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2C(=NC(=N2)OCC(C)C)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H24ClN3O2/c1-4-17(16-10-6-5-7-11-16)21(27)26-20(18-12-8-9-13-19(18)23)24-22(25-26)28-14-15(2)3/h5-13,15,17H,4,14H2,1-3H3