1-[2-(4-fluorophenyl)ethyl]benzotriazole-5-carboxylate

Systemtic Name: 1-[2-(4-fluorophenyl)ethyl]benzotriazole-5-carboxylate Openeye Name: 1-[2-(4-fluorophenyl)ethyl]benzotriazole-5-carboxylate CAS Name: 1-[2-(4-fluorophenyl)ethyl]-5-benzotriazolecarboxylate IUPAC Name: 1-[2-(4-fluorophenyl)ethyl]benzotriazole-5-carboxylate Traditional Name: 1-[2-(4-fluorophenyl)ethyl]benzotriazole-5-carboxylate Formula: C15H11FN3O2- MolecularWeight: 284.265143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCN2C3=C(C=C(C=C3)C(=O)[O-])N=N2)F

Isomeric SMILES

C1=CC(=CC=C1CCN2C3=C(C=C(C=C3)C(=O)[O-])N=N2)F

InChI

InChI=1S/C15H12FN3O2/c16-12-4-1-10(2-5-12)7-8-19-14-6-3-11(15(20)21)9-13(14)17-18-19/h1-6,9H,7-8H2,(H,20,21)/p-1