3-(4-methoxycarbonylphenyl)-1-(3-methylphenyl)-5-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-(4-methoxycarbonylphenyl)-1-(3-methylphenyl)-5-phenyl-pyrazole-4-carboxylic acid Openeye Name: 3-(4-methoxycarbonylphenyl)-1-(m-tolyl)-5-phenyl-pyrazole-4-carboxylic acid CAS Name: 3-(4-methoxycarbonylphenyl)-1-(3-methylphenyl)-5-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(4-methoxycarbonylphenyl)-1-(3-methylphenyl)-5-phenylpyrazole-4-carboxylic acid Traditional Name: 3-(4-carbomethoxyphenyl)-1-(m-tolyl)-5-phenyl-pyrazole-4-carboxylic acid Formula: C25H20N2O4 MolecularWeight: 412.4373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C(=N2)C3=CC=C(C=C3)C(=O)OC)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C(=N2)C3=CC=C(C=C3)C(=O)OC)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C25H20N2O4/c1-16-7-6-10-20(15-16)27-23(18-8-4-3-5-9-18)21(24(28)29)22(26-27)17-11-13-19(14-12-17)25(30)31-2/h3-15H,1-2H3,(H,28,29)