3-[6-(trifluoromethyl)benzotriazol-1-yl]butanoic acid

Systemtic Name: 3-[6-(trifluoromethyl)benzotriazol-1-yl]butanoic acid Openeye Name: 3-[6-(trifluoromethyl)benzotriazol-1-yl]butanoic acid CAS Name: 3-[6-(trifluoromethyl)-1-benzotriazolyl]butanoic acid IUPAC Name: 3-[6-(trifluoromethyl)benzotriazol-1-yl]butanoic acid Traditional Name: 3-[6-(trifluoromethyl)benzotriazol-1-yl]butyric acid Formula: C11H10F3N3O2 MolecularWeight: 273.21121

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)N1C2=C(C=CC(=C2)C(F)(F)F)N=N1

Isomeric SMILES

CC(CC(=O)O)N1C2=C(C=CC(=C2)C(F)(F)F)N=N1

InChI

InChI=1S/C11H10F3N3O2/c1-6(4-10(18)19)17-9-5-7(11(12,13)14)2-3-8(9)15-16-17/h2-3,5-6H,4H2,1H3,(H,18,19)