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

Systemtic Name: 5-ethyl-3-(4-methoxycarbonylphenyl)-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid Openeye Name: 5-ethyl-3-(4-methoxycarbonylphenyl)-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid CAS Name: 5-ethyl-3-(4-methoxycarbonylphenyl)-1-(4-methoxyphenyl)-4-pyrazolecarboxylic acid IUPAC Name: 5-ethyl-3-(4-methoxycarbonylphenyl)-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid Traditional Name: 3-(4-carbomethoxyphenyl)-5-ethyl-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)C(=O)OC)C(=O)O

Isomeric SMILES

CCC1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)C(=O)OC)C(=O)O

InChI

InChI=1S/C21H20N2O5/c1-4-17-18(20(24)25)19(13-5-7-14(8-6-13)21(26)28-3)22-23(17)15-9-11-16(27-2)12-10-15/h5-12H,4H2,1-3H3,(H,24,25)