phenacyl 2-(3-chlorophenyl)-5-methyl-1,2,3-triazole-4-carboxylate

Systemtic Name: phenacyl 2-(3-chlorophenyl)-5-methyl-1,2,3-triazole-4-carboxylate Openeye Name: phenacyl 2-(3-chlorophenyl)-5-methyl-triazole-4-carboxylate CAS Name: 2-(3-chlorophenyl)-5-methyl-4-triazolecarboxylic acid phenacyl ester IUPAC Name: phenacyl 2-(3-chlorophenyl)-5-methyltriazole-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-5-methyl-triazole-4-carboxylic acid phenacyl ester Formula: C18H14ClN3O3 MolecularWeight: 355.77506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)OCC(=O)C2=CC=CC=C2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=NN(N=C1C(=O)OCC(=O)C2=CC=CC=C2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H14ClN3O3/c1-12-17(21-22(20-12)15-9-5-8-14(19)10-15)18(24)25-11-16(23)13-6-3-2-4-7-13/h2-10H,11H2,1H3