2-[4-(3-chloranyl-5-cyano-phenoxy)-5-methyl-1H-pyrazol-3-yl]ethanoic acid

Systemtic Name: 2-[4-(3-chloranyl-5-cyano-phenoxy)-5-methyl-1H-pyrazol-3-yl]ethanoic acid Openeye Name: 2-[4-(3-chloro-5-cyano-phenoxy)-5-methyl-1H-pyrazol-3-yl]acetic acid CAS Name: 2-[4-(3-chloro-5-cyanophenoxy)-5-methyl-1H-pyrazol-3-yl]acetic acid IUPAC Name: 2-[4-(3-chloro-5-cyanophenoxy)-5-methyl-1H-pyrazol-3-yl]acetic acid Traditional Name: 2-[4-(3-chloro-5-cyano-phenoxy)-5-methyl-1H-pyrazol-3-yl]acetic acid Formula: C13H10ClN3O3 MolecularWeight: 291.6898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)CC(=O)O)OC2=CC(=CC(=C2)C#N)Cl

Isomeric SMILES

CC1=C(C(=NN1)CC(=O)O)OC2=CC(=CC(=C2)C#N)Cl

InChI

InChI=1S/C13H10ClN3O3/c1-7-13(11(17-16-7)5-12(18)19)20-10-3-8(6-15)2-9(14)4-10/h2-4H,5H2,1H3,(H,16,17)(H,18,19)