ethyl 1-(4-iodophenyl)-5-methyl-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-(4-iodophenyl)-5-methyl-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-(4-iodophenyl)-5-methyl-triazole-4-carboxylate CAS Name: 1-(4-iodophenyl)-5-methyl-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-iodophenyl)-5-methyltriazole-4-carboxylate Traditional Name: 1-(4-iodophenyl)-5-methyl-triazole-4-carboxylic acid ethyl ester Formula: C12H12IN3O2 MolecularWeight: 357.14705

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=CC=C(C=C2)I)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=CC=C(C=C2)I)C

InChI

InChI=1S/C12H12IN3O2/c1-3-18-12(17)11-8(2)16(15-14-11)10-6-4-9(13)5-7-10/h4-7H,3H2,1-2H3