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

Systemtic Name: 2-[4-[[[5-(4-tert-butylphenyl)-2-ethyl-pyrazol-3-yl]carbonylamino]methyl]-2-methoxy-phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[[[5-(4-tert-butylphenyl)-2-ethyl-pyrazole-3-carbonyl]amino]methyl]-2-methoxy-phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[[[[5-(4-tert-butylphenyl)-2-ethyl-3-pyrazolyl]-oxomethyl]amino]methyl]-2-methoxyphenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[[[5-(4-tert-butylphenyl)-2-ethylpyrazole-3-carbonyl]amino]methyl]-2-methoxyphenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[[[5-(4-tert-butylphenyl)-2-ethyl-pyrazole-3-carbonyl]amino]methyl]-2-methoxy-phenoxy]-2-methyl-propionic acid Formula: C28H35N3O5 MolecularWeight: 493.5946

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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)OC

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)OC

InChI

InChI=1S/C28H35N3O5/c1-8-31-22(16-21(30-31)19-10-12-20(13-11-19)27(2,3)4)25(32)29-17-18-9-14-23(24(15-18)35-7)36-28(5,6)26(33)34/h9-16H,8,17H2,1-7H3,(H,29,32)(H,33,34)