2-(2-fluoranylphenoxy)ethyl 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: 2-(2-fluoranylphenoxy)ethyl 1-ethylbenzotriazole-5-carboxylate Openeye Name: 2-(2-fluorophenoxy)ethyl 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid 2-(2-fluorophenoxy)ethyl ester IUPAC Name: 2-(2-fluorophenoxy)ethyl 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid 2-(2-fluorophenoxy)ethyl ester Formula: C17H16FN3O3 MolecularWeight: 329.325643

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCCOC3=CC=CC=C3F)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCCOC3=CC=CC=C3F)N=N1

InChI

InChI=1S/C17H16FN3O3/c1-2-21-15-8-7-12(11-14(15)19-20-21)17(22)24-10-9-23-16-6-4-3-5-13(16)18/h3-8,11H,2,9-10H2,1H3