1-(3-fluoranyl-4-methoxy-phenyl)-4-(2-hydroxyethyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-(3-fluoranyl-4-methoxy-phenyl)-4-(2-hydroxyethyl)pyrazole-3-carboxylic acid Openeye Name: 1-(3-fluoro-4-methoxy-phenyl)-4-(2-hydroxyethyl)pyrazole-3-carboxylic acid CAS Name: 1-(3-fluoro-4-methoxyphenyl)-4-(2-hydroxyethyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(3-fluoro-4-methoxyphenyl)-4-(2-hydroxyethyl)pyrazole-3-carboxylic acid Traditional Name: 1-(3-fluoro-4-methoxy-phenyl)-4-(2-hydroxyethyl)pyrazole-3-carboxylic acid Formula: C13H13FN2O4 MolecularWeight: 280.251723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C=C(C(=N2)C(=O)O)CCO)F

Isomeric SMILES

COC1=C(C=C(C=C1)N2C=C(C(=N2)C(=O)O)CCO)F

InChI

InChI=1S/C13H13FN2O4/c1-20-11-3-2-9(6-10(11)14)16-7-8(4-5-17)12(15-16)13(18)19/h2-3,6-7,17H,4-5H2,1H3,(H,18,19)