3-(5-chloranyl-2-methoxy-3-methyl-phenyl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(5-chloranyl-2-methoxy-3-methyl-phenyl)-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(5-chloro-2-methoxy-3-methyl-phenyl)-1H-pyrazole-5-carboxylic acid CAS Name: 3-(5-chloro-2-methoxy-3-methylphenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-(5-chloro-2-methoxy-3-methylphenyl)-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(5-chloro-2-methoxy-3-methyl-phenyl)-1H-pyrazole-5-carboxylic acid Formula: C12H11ClN2O3 MolecularWeight: 266.68034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Cl)C2=NNC(=C2)C(=O)O)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Cl)C2=NNC(=C2)C(=O)O)OC

InChI

InChI=1S/C12H11ClN2O3/c1-6-3-7(13)4-8(11(6)18-2)9-5-10(12(16)17)15-14-9/h3-5H,1-2H3,(H,14,15)(H,16,17)