3-(2-methoxy-4,5-dimethyl-phenyl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(2-methoxy-4,5-dimethyl-phenyl)-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(2-methoxy-4,5-dimethyl-phenyl)-1H-pyrazole-5-carboxylic acid CAS Name: 3-(2-methoxy-4,5-dimethylphenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-(2-methoxy-4,5-dimethylphenyl)-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(2-methoxy-4,5-dimethyl-phenyl)-1H-pyrazole-5-carboxylic acid Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O3/c1-7-4-9(12(18-3)5-8(7)2)10-6-11(13(16)17)15-14-10/h4-6H,1-3H3,(H,14,15)(H,16,17)