1-[(4-fluorophenyl)methyl]benzotriazole-5-carboxylate

Systemtic Name: 1-[(4-fluorophenyl)methyl]benzotriazole-5-carboxylate Openeye Name: 1-[(4-fluorophenyl)methyl]benzotriazole-5-carboxylate CAS Name: 1-[(4-fluorophenyl)methyl]-5-benzotriazolecarboxylate IUPAC Name: 1-[(4-fluorophenyl)methyl]benzotriazole-5-carboxylate Traditional Name: 1-(4-fluorobenzyl)benzotriazole-5-carboxylate Formula: C14H9FN3O2- MolecularWeight: 270.238563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C3=C(C=C(C=C3)C(=O)[O-])N=N2)F

Isomeric SMILES

C1=CC(=CC=C1CN2C3=C(C=C(C=C3)C(=O)[O-])N=N2)F

InChI

InChI=1S/C14H10FN3O2/c15-11-4-1-9(2-5-11)8-18-13-6-3-10(14(19)20)7-12(13)16-17-18/h1-7H,8H2,(H,19,20)/p-1