1-[1-(4-chlorophenyl)-1,2,3-triazol-4-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[1-(4-chlorophenyl)-1,2,3-triazol-4-yl]-2-methyl-propan-1-one Openeye Name: 1-[1-(4-chlorophenyl)triazol-4-yl]-2-methyl-propan-1-one CAS Name: 1-[1-(4-chlorophenyl)-4-triazolyl]-2-methyl-1-propanone IUPAC Name: 1-[1-(4-chlorophenyl)triazol-4-yl]-2-methylpropan-1-one Traditional Name: 1-[1-(4-chlorophenyl)triazol-4-yl]-2-methyl-propan-1-one Formula: C12H12ClN3O MolecularWeight: 249.69618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=CN(N=N1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)C(=O)C1=CN(N=N1)C2=CC=C(C=C2)Cl

InChI

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