1-(4-ethoxycarbonylphenyl)-5-phenyl-pyrazole-3,4-dicarboxylic acid

Systemtic Name: 1-(4-ethoxycarbonylphenyl)-5-phenyl-pyrazole-3,4-dicarboxylic acid Openeye Name: 1-(4-ethoxycarbonylphenyl)-5-phenyl-pyrazole-3,4-dicarboxylic acid CAS Name: 1-(4-ethoxycarbonylphenyl)-5-phenylpyrazole-3,4-dicarboxylic acid IUPAC Name: 1-(4-ethoxycarbonylphenyl)-5-phenylpyrazole-3,4-dicarboxylic acid Traditional Name: 1-(4-carbethoxyphenyl)-5-phenyl-pyrazole-3,4-dicarboxylic acid Formula: C20H16N2O6 MolecularWeight: 380.35084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=C(C(=N2)C(=O)O)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=C(C(=N2)C(=O)O)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C20H16N2O6/c1-2-28-20(27)13-8-10-14(11-9-13)22-17(12-6-4-3-5-7-12)15(18(23)24)16(21-22)19(25)26/h3-11H,2H2,1H3,(H,23,24)(H,25,26)