4-[2-(5-aminocarbonyl-1H-pyrazol-3-yl)-5-(pyridin-3-ylmethoxy)phenoxy]-4-(2-methylphenyl)butanoic acid

Systemtic Name: 4-[2-(5-aminocarbonyl-1H-pyrazol-3-yl)-5-(pyridin-3-ylmethoxy)phenoxy]-4-(2-methylphenyl)butanoic acid Openeye Name: 4-[2-(5-carbamoyl-1H-pyrazol-3-yl)-5-(3-pyridylmethoxy)phenoxy]-4-(o-tolyl)butanoic acid CAS Name: 4-[2-(5-carbamoyl-1H-pyrazol-3-yl)-5-(3-pyridinylmethoxy)phenoxy]-4-(2-methylphenyl)butanoic acid IUPAC Name: 4-[2-(5-carbamoyl-1H-pyrazol-3-yl)-5-(pyridin-3-ylmethoxy)phenoxy]-4-(2-methylphenyl)butanoic acid Traditional Name: 4-[2-(5-carbamoyl-1H-pyrazol-3-yl)-5-(3-pyridylmethoxy)phenoxy]-4-(o-tolyl)butyric acid Formula: C27H26N4O5 MolecularWeight: 486.51914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCC(=O)O)OC2=C(C=CC(=C2)OCC3=CN=CC=C3)C4=NNC(=C4)C(=O)N

Isomeric SMILES

CC1=CC=CC=C1C(CCC(=O)O)OC2=C(C=CC(=C2)OCC3=CN=CC=C3)C4=NNC(=C4)C(=O)N

InChI

InChI=1S/C27H26N4O5/c1-17-5-2-3-7-20(17)24(10-11-26(32)33)36-25-13-19(35-16-18-6-4-12-29-15-18)8-9-21(25)22-14-23(27(28)34)31-30-22/h2-9,12-15,24H,10-11,16H2,1H3,(H2,28,34)(H,30,31)(H,32,33)