2-[[5-tert-butyl-2-(2-ethoxyphenyl)pyrazol-3-yl]amino]benzoic acid

Systemtic Name: 2-[[5-tert-butyl-2-(2-ethoxyphenyl)pyrazol-3-yl]amino]benzoic acid Openeye Name: 2-[[5-tert-butyl-2-(2-ethoxyphenyl)pyrazol-3-yl]amino]benzoic acid CAS Name: 2-[[5-tert-butyl-2-(2-ethoxyphenyl)-3-pyrazolyl]amino]benzoic acid IUPAC Name: 2-[[5-tert-butyl-2-(2-ethoxyphenyl)pyrazol-3-yl]amino]benzoic acid Traditional Name: 2-[(5-tert-butyl-2-o-phenetyl-pyrazol-3-yl)amino]benzoic acid Formula: C22H25N3O3 MolecularWeight: 379.4522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C22H25N3O3/c1-5-28-18-13-9-8-12-17(18)25-20(14-19(24-25)22(2,3)4)23-16-11-7-6-10-15(16)21(26)27/h6-14,23H,5H2,1-4H3,(H,26,27)