1-[2-(4-chlorophenyl)-3,3-dimethyl-1H-1,2,4-triazol-5-yl]ethanone

Systemtic Name: 1-[2-(4-chlorophenyl)-3,3-dimethyl-1H-1,2,4-triazol-5-yl]ethanone Openeye Name: 1-[2-(4-chlorophenyl)-3,3-dimethyl-1H-1,2,4-triazol-5-yl]ethanone CAS Name: 1-[2-(4-chlorophenyl)-3,3-dimethyl-1H-1,2,4-triazol-5-yl]ethanone IUPAC Name: 1-[2-(4-chlorophenyl)-3,3-dimethyl-1H-1,2,4-triazol-5-yl]ethanone Traditional Name: 1-[2-(4-chlorophenyl)-3,3-dimethyl-1H-1,2,4-triazol-5-yl]ethanone Formula: C12H14ClN3O MolecularWeight: 251.71206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClN3O/c1-8(17)11-14-12(2,3)16(15-11)10-6-4-9(13)5-7-10/h4-7H,1-3H3,(H,14,15)