3-(4-methoxycarbonylphenyl)-1-(4-methoxyphenyl)-5-propyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-(4-methoxycarbonylphenyl)-1-(4-methoxyphenyl)-5-propyl-pyrazole-4-carboxylic acid Openeye Name: 3-(4-methoxycarbonylphenyl)-1-(4-methoxyphenyl)-5-propyl-pyrazole-4-carboxylic acid CAS Name: 3-(4-methoxycarbonylphenyl)-1-(4-methoxyphenyl)-5-propyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(4-methoxycarbonylphenyl)-1-(4-methoxyphenyl)-5-propylpyrazole-4-carboxylic acid Traditional Name: 3-(4-carbomethoxyphenyl)-1-(4-methoxyphenyl)-5-propyl-pyrazole-4-carboxylic acid Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)C(=O)OC)C(=O)O

Isomeric SMILES

CCCC1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)C(=O)OC)C(=O)O

InChI

InChI=1S/C22H22N2O5/c1-4-5-18-19(21(25)26)20(14-6-8-15(9-7-14)22(27)29-3)23-24(18)16-10-12-17(28-2)13-11-16/h6-13H,4-5H2,1-3H3,(H,25,26)