ethyl 1-phenethylbenzotriazole-5-carboxylate

Systemtic Name: ethyl 1-phenethylbenzotriazole-5-carboxylate Openeye Name: ethyl 1-phenethylbenzotriazole-5-carboxylate CAS Name: 1-phenethyl-5-benzotriazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-phenethylbenzotriazole-5-carboxylate Traditional Name: 1-phenethylbenzotriazole-5-carboxylic acid ethyl ester Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(N=N2)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(N=N2)CCC3=CC=CC=C3

InChI

InChI=1S/C17H17N3O2/c1-2-22-17(21)14-8-9-16-15(12-14)18-19-20(16)11-10-13-6-4-3-5-7-13/h3-9,12H,2,10-11H2,1H3