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

Systemtic Name: 2-[4-[[[5-(4-tert-butylphenyl)-2-phenethyl-pyrazol-3-yl]carbonylamino]methyl]-2-methyl-phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[[[5-(4-tert-butylphenyl)-2-phenethyl-pyrazole-3-carbonyl]amino]methyl]-2-methyl-phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[[[[5-(4-tert-butylphenyl)-2-phenethyl-3-pyrazolyl]-oxomethyl]amino]methyl]-2-methylphenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[[[5-(4-tert-butylphenyl)-2-phenethylpyrazole-3-carbonyl]amino]methyl]-2-methylphenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[[[5-(4-tert-butylphenyl)-2-phenethyl-pyrazole-3-carbonyl]amino]methyl]-2-methyl-phenoxy]-2-methyl-propionic acid Formula: C34H39N3O4 MolecularWeight: 553.69116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C2=CC(=NN2CCC3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C)OC(C)(C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)C2=CC(=NN2CCC3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C)OC(C)(C)C(=O)O

InChI

InChI=1S/C34H39N3O4/c1-23-20-25(12-17-30(23)41-34(5,6)32(39)40)22-35-31(38)29-21-28(26-13-15-27(16-14-26)33(2,3)4)36-37(29)19-18-24-10-8-7-9-11-24/h7-17,20-21H,18-19,22H2,1-6H3,(H,35,38)(H,39,40)