1-(4-chlorophenyl)-2-methyl-2-(1,2,4-triazol-1-yl)propan-1-one

Systemtic Name: 1-(4-chlorophenyl)-2-methyl-2-(1,2,4-triazol-1-yl)propan-1-one Openeye Name: 1-(4-chlorophenyl)-2-methyl-2-(1,2,4-triazol-1-yl)propan-1-one CAS Name: 1-(4-chlorophenyl)-2-methyl-2-(1,2,4-triazol-1-yl)-1-propanone IUPAC Name: 1-(4-chlorophenyl)-2-methyl-2-(1,2,4-triazol-1-yl)propan-1-one Traditional Name: 1-(4-chlorophenyl)-2-methyl-2-(1,2,4-triazol-1-yl)propan-1-one Formula: C12H12ClN3O MolecularWeight: 249.69618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC=C(C=C1)Cl)N2C=NC=N2

Isomeric SMILES

CC(C)(C(=O)C1=CC=C(C=C1)Cl)N2C=NC=N2

InChI

InChI=1S/C12H12ClN3O/c1-12(2,16-8-14-7-15-16)11(17)9-3-5-10(13)6-4-9/h3-8H,1-2H3