1-[4-(carboxymethyl)naphthalen-1-yl]-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-[4-(carboxymethyl)naphthalen-1-yl]-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid Openeye Name: 1-[4-(carboxymethyl)-1-naphthyl]-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid CAS Name: 1-[4-(carboxymethyl)-1-naphthalenyl]-5-(2,6-dimethoxyphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-[4-(carboxymethyl)naphthalen-1-yl]-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid Traditional Name: 1-[4-(carboxymethyl)-1-naphthyl]-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid Formula: C24H20N2O6 MolecularWeight: 432.4254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C2=CC(=NN2C3=CC=C(C4=CC=CC=C43)CC(=O)O)C(=O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C2=CC(=NN2C3=CC=C(C4=CC=CC=C43)CC(=O)O)C(=O)O

InChI

InChI=1S/C24H20N2O6/c1-31-20-8-5-9-21(32-2)23(20)19-13-17(24(29)30)25-26(19)18-11-10-14(12-22(27)28)15-6-3-4-7-16(15)18/h3-11,13H,12H2,1-2H3,(H,27,28)(H,29,30)