2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-fluoranyl-benzoic acid

Systemtic Name: 2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-fluoranyl-benzoic acid Openeye Name: 2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-fluoro-benzoic acid CAS Name: 2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-fluorobenzoic acid IUPAC Name: 2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-fluorobenzoic acid Traditional Name: 2-(3,5-dimethylol-1,2,4-triazol-4-yl)-5-fluoro-benzoic acid Formula: C11H10FN3O4 MolecularWeight: 267.213203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)C(=O)O)N2C(=NN=C2CO)CO

Isomeric SMILES

C1=CC(=C(C=C1F)C(=O)O)N2C(=NN=C2CO)CO

InChI

InChI=1S/C11H10FN3O4/c12-6-1-2-8(7(3-6)11(18)19)15-9(4-16)13-14-10(15)5-17/h1-3,16-17H,4-5H2,(H,18,19)