4-[2-(4-carboxyphenyl)-3-phenyl-3,4-dihydropyrazol-5-yl]naphthalene-1,8-dicarboxylic acid

Systemtic Name: 4-[2-(4-carboxyphenyl)-3-phenyl-3,4-dihydropyrazol-5-yl]naphthalene-1,8-dicarboxylic acid Openeye Name: 4-[2-(4-carboxyphenyl)-3-phenyl-3,4-dihydropyrazol-5-yl]naphthalene-1,8-dicarboxylic acid CAS Name: 4-[2-(4-carboxyphenyl)-3-phenyl-3,4-dihydropyrazol-5-yl]naphthalene-1,8-dicarboxylic acid IUPAC Name: 4-[2-(4-carboxyphenyl)-3-phenyl-3,4-dihydropyrazol-5-yl]naphthalene-1,8-dicarboxylic acid Traditional Name: 4-[1-(4-carboxyphenyl)-5-phenyl-2-pyrazolin-3-yl]naphthalic acid Formula: C28H20N2O6 MolecularWeight: 480.4682

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=C3C=CC=C(C3=C(C=C2)C(=O)O)C(=O)O)C4=CC=C(C=C4)C(=O)O)C5=CC=CC=C5

Isomeric SMILES

C1C(N(N=C1C2=C3C=CC=C(C3=C(C=C2)C(=O)O)C(=O)O)C4=CC=C(C=C4)C(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C28H20N2O6/c31-26(32)17-9-11-18(12-10-17)30-24(16-5-2-1-3-6-16)15-23(29-30)19-13-14-22(28(35)36)25-20(19)7-4-8-21(25)27(33)34/h1-14,24H,15H2,(H,31,32)(H,33,34)(H,35,36)