1-[[3,5-bis(fluoranyl)phenyl]methyl]benzotriazole-5-carboxylic acid

Systemtic Name: 1-[[3,5-bis(fluoranyl)phenyl]methyl]benzotriazole-5-carboxylic acid Openeye Name: 1-[(3,5-difluorophenyl)methyl]benzotriazole-5-carboxylic acid CAS Name: 1-[(3,5-difluorophenyl)methyl]-5-benzotriazolecarboxylic acid IUPAC Name: 1-[(3,5-difluorophenyl)methyl]benzotriazole-5-carboxylic acid Traditional Name: 1-(3,5-difluorobenzyl)benzotriazole-5-carboxylic acid Formula: C14H9F2N3O2 MolecularWeight: 289.236966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)N=NN2CC3=CC(=CC(=C3)F)F

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)N=NN2CC3=CC(=CC(=C3)F)F

InChI

InChI=1S/C14H9F2N3O2/c15-10-3-8(4-11(16)6-10)7-19-13-2-1-9(14(20)21)5-12(13)17-18-19/h1-6H,7H2,(H,20,21)