(2-cyanophenyl) 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: (2-cyanophenyl) 1-ethylbenzotriazole-5-carboxylate Openeye Name: (2-cyanophenyl) 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid (2-cyanophenyl) ester IUPAC Name: (2-cyanophenyl) 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid (2-cyanophenyl) ester Formula: C16H12N4O2 MolecularWeight: 292.29208

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OC3=CC=CC=C3C#N)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OC3=CC=CC=C3C#N)N=N1

InChI

InChI=1S/C16H12N4O2/c1-2-20-14-8-7-11(9-13(14)18-19-20)16(21)22-15-6-4-3-5-12(15)10-17/h3-9H,2H2,1H3