(4-iodophenyl) 2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: (4-iodophenyl) 2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: (4-iodophenyl) 2-phenyltriazole-4-carboxylate CAS Name: 2-phenyl-4-triazolecarboxylic acid (4-iodophenyl) ester IUPAC Name: (4-iodophenyl) 2-phenyltriazole-4-carboxylate Traditional Name: 2-phenyltriazole-4-carboxylic acid (4-iodophenyl) ester Formula: C15H10IN3O2 MolecularWeight: 391.16327

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=CC(=N2)C(=O)OC3=CC=C(C=C3)I

Isomeric SMILES

C1=CC=C(C=C1)N2N=CC(=N2)C(=O)OC3=CC=C(C=C3)I

InChI

InChI=1S/C15H10IN3O2/c16-11-6-8-13(9-7-11)21-15(20)14-10-17-19(18-14)12-4-2-1-3-5-12/h1-10H