(3-chlorophenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate

Systemtic Name: (3-chlorophenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate Openeye Name: (3-chlorophenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate CAS Name: 4-(1,2,4-triazol-1-yl)benzoic acid (3-chlorophenyl)methyl ester IUPAC Name: (3-chlorophenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate Traditional Name: 4-(1,2,4-triazol-1-yl)benzoic acid (3-chlorobenzyl) ester Formula: C16H12ClN3O2 MolecularWeight: 313.73838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)COC(=O)C2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

C1=CC(=CC(=C1)Cl)COC(=O)C2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C16H12ClN3O2/c17-14-3-1-2-12(8-14)9-22-16(21)13-4-6-15(7-5-13)20-11-18-10-19-20/h1-8,10-11H,9H2