1-(1,3-benzoxazol-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid Openeye Name: 1-(1,3-benzoxazol-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid CAS Name: 1-(1,3-benzoxazol-2-yl)-5-(trifluoromethyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(1,3-benzoxazol-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid Traditional Name: 1-(1,3-benzoxazol-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid Formula: C12H6F3N3O3 MolecularWeight: 297.18955

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)N3C(=C(C=N3)C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)N3C(=C(C=N3)C(=O)O)C(F)(F)F

InChI

InChI=1S/C12H6F3N3O3/c13-12(14,15)9-6(10(19)20)5-16-18(9)11-17-7-3-1-2-4-8(7)21-11/h1-5H,(H,19,20)