3-(2,3,4-trimethoxyphenyl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(2,3,4-trimethoxyphenyl)-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(2,3,4-trimethoxyphenyl)-1H-pyrazole-5-carboxylic acid CAS Name: 3-(2,3,4-trimethoxyphenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-(2,3,4-trimethoxyphenyl)-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(2,3,4-trimethoxyphenyl)-1H-pyrazole-5-carboxylic acid Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=NNC(=C2)C(=O)O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=NNC(=C2)C(=O)O)OC)OC

InChI

InChI=1S/C13H14N2O5/c1-18-10-5-4-7(11(19-2)12(10)20-3)8-6-9(13(16)17)15-14-8/h4-6H,1-3H3,(H,14,15)(H,16,17)