(1-cyanoindolizin-2-yl)methyl 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 1-ethylbenzotriazole-5-carboxylate Openeye Name: (1-cyanoindolizin-2-yl)methyl 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C19H15N5O2 MolecularWeight: 345.3547

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC3=CN4C=CC=CC4=C3C#N)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC3=CN4C=CC=CC4=C3C#N)N=N1

InChI

InChI=1S/C19H15N5O2/c1-2-24-18-7-6-13(9-16(18)21-22-24)19(25)26-12-14-11-23-8-4-3-5-17(23)15(14)10-20/h3-9,11H,2,12H2,1H3