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

Systemtic Name: 2-[4-[[[5-(4-tert-butylphenyl)-2-ethyl-pyrazol-3-yl]carbonylamino]methyl]-2-methyl-phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[[[5-(4-tert-butylphenyl)-2-ethyl-pyrazole-3-carbonyl]amino]methyl]-2-methyl-phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[[[[5-(4-tert-butylphenyl)-2-ethyl-3-pyrazolyl]-oxomethyl]amino]methyl]-2-methylphenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[[[5-(4-tert-butylphenyl)-2-ethylpyrazole-3-carbonyl]amino]methyl]-2-methylphenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[[[5-(4-tert-butylphenyl)-2-ethyl-pyrazole-3-carbonyl]amino]methyl]-2-methyl-phenoxy]-2-methyl-propionic acid Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)NCC3=CC(=C(C=C3)OC(C)(C)C(=O)O)C

Isomeric SMILES

CCN1C(=CC(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)NCC3=CC(=C(C=C3)OC(C)(C)C(=O)O)C

InChI

InChI=1S/C28H35N3O4/c1-8-31-23(16-22(30-31)20-10-12-21(13-11-20)27(3,4)5)25(32)29-17-19-9-14-24(18(2)15-19)35-28(6,7)26(33)34/h9-16H,8,17H2,1-7H3,(H,29,32)(H,33,34)