3-(5-carboxylato-2,4-dimethoxy-phenyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: 3-(5-carboxylato-2,4-dimethoxy-phenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: 3-(5-carboxylato-2,4-dimethoxy-phenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(5-carboxylato-2,4-dimethoxyphenyl)-1-phenyl-4-pyrazolecarboxylate IUPAC Name: 3-(5-carboxylato-2,4-dimethoxyphenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(5-carboxylato-2,4-dimethoxy-phenyl)-1-phenyl-pyrazole-4-carboxylate Formula: C19H14N2O6-2 MolecularWeight: 366.32426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=NN(C=C2C(=O)[O-])C3=CC=CC=C3)C(=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1C2=NN(C=C2C(=O)[O-])C3=CC=CC=C3)C(=O)[O-])OC

InChI

InChI=1S/C19H16N2O6/c1-26-15-9-16(27-2)13(18(22)23)8-12(15)17-14(19(24)25)10-21(20-17)11-6-4-3-5-7-11/h3-10H,1-2H3,(H,22,23)(H,24,25)/p-2