4-(4-methyl-5-phenyl-1,2,4-triazol-3-yl)benzoyl chloride

Systemtic Name: 4-(4-methyl-5-phenyl-1,2,4-triazol-3-yl)benzoyl chloride Openeye Name: 4-(4-methyl-5-phenyl-1,2,4-triazol-3-yl)benzoyl chloride CAS Name: 4-(4-methyl-5-phenyl-1,2,4-triazol-3-yl)benzoyl chloride IUPAC Name: 4-(4-methyl-5-phenyl-1,2,4-triazol-3-yl)benzoyl chloride Traditional Name: 4-(4-methyl-5-phenyl-1,2,4-triazol-3-yl)benzoyl chloride Formula: C16H12ClN3O MolecularWeight: 297.73898

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1C2=CC=C(C=C2)C(=O)Cl)C3=CC=CC=C3

Isomeric SMILES

CN1C(=NN=C1C2=CC=C(C=C2)C(=O)Cl)C3=CC=CC=C3

InChI

InChI=1S/C16H12ClN3O/c1-20-15(12-5-3-2-4-6-12)18-19-16(20)13-9-7-11(8-10-13)14(17)21/h2-10H,1H3