2-[4-[[[3-(4-tert-butylphenyl)-1H-pyrazol-5-yl]carbonylamino]methyl]-2-methyl-phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[[[3-(4-tert-butylphenyl)-1H-pyrazol-5-yl]carbonylamino]methyl]-2-methyl-phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[[[3-(4-tert-butylphenyl)-1H-pyrazole-5-carbonyl]amino]methyl]-2-methyl-phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[[[[3-(4-tert-butylphenyl)-1H-pyrazol-5-yl]-oxomethyl]amino]methyl]-2-methylphenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[[[3-(4-tert-butylphenyl)-1H-pyrazole-5-carbonyl]amino]methyl]-2-methylphenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[[[3-(4-tert-butylphenyl)-1H-pyrazole-5-carbonyl]amino]methyl]-2-methyl-phenoxy]-2-methyl-propionic acid Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C2=CC(=NN2)C3=CC=C(C=C3)C(C)(C)C)OC(C)(C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)C2=CC(=NN2)C3=CC=C(C=C3)C(C)(C)C)OC(C)(C)C(=O)O

InChI

InChI=1S/C26H31N3O4/c1-16-13-17(7-12-22(16)33-26(5,6)24(31)32)15-27-23(30)21-14-20(28-29-21)18-8-10-19(11-9-18)25(2,3)4/h7-14H,15H2,1-6H3,(H,27,30)(H,28,29)(H,31,32)