5-methoxy-2-[[5-methyl-2-(2-methylphenyl)-4-phenyl-pyrazol-3-yl]amino]benzoic acid

Systemtic Name: 5-methoxy-2-[[5-methyl-2-(2-methylphenyl)-4-phenyl-pyrazol-3-yl]amino]benzoic acid Openeye Name: 5-methoxy-2-[[5-methyl-2-(o-tolyl)-4-phenyl-pyrazol-3-yl]amino]benzoic acid CAS Name: 5-methoxy-2-[[5-methyl-2-(2-methylphenyl)-4-phenyl-3-pyrazolyl]amino]benzoic acid IUPAC Name: 5-methoxy-2-[[5-methyl-2-(2-methylphenyl)-4-phenylpyrazol-3-yl]amino]benzoic acid Traditional Name: 5-methoxy-2-[[5-methyl-2-(o-tolyl)-4-phenyl-pyrazol-3-yl]amino]benzoic acid Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=N2)C)C3=CC=CC=C3)NC4=C(C=C(C=C4)OC)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=N2)C)C3=CC=CC=C3)NC4=C(C=C(C=C4)OC)C(=O)O

InChI

InChI=1S/C25H23N3O3/c1-16-9-7-8-12-22(16)28-24(23(17(2)27-28)18-10-5-4-6-11-18)26-21-14-13-19(31-3)15-20(21)25(29)30/h4-15,26H,1-3H3,(H,29,30)