1-[(3-fluorophenyl)methyl]benzotriazole-5-carboxylic acid

Systemtic Name: 1-[(3-fluorophenyl)methyl]benzotriazole-5-carboxylic acid Openeye Name: 1-[(3-fluorophenyl)methyl]benzotriazole-5-carboxylic acid CAS Name: 1-[(3-fluorophenyl)methyl]-5-benzotriazolecarboxylic acid IUPAC Name: 1-[(3-fluorophenyl)methyl]benzotriazole-5-carboxylic acid Traditional Name: 1-(3-fluorobenzyl)benzotriazole-5-carboxylic acid Formula: C14H10FN3O2 MolecularWeight: 271.246503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CN2C3=C(C=C(C=C3)C(=O)O)N=N2

Isomeric SMILES

C1=CC(=CC(=C1)F)CN2C3=C(C=C(C=C3)C(=O)O)N=N2

InChI

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