3-[2-methyl-4-[2-[5-methyl-2-(4-pyrimidin-5-ylphenyl)-1,3-oxazol-4-yl]ethoxy]phenyl]propanoic acid

Systemtic Name: 3-[2-methyl-4-[2-[5-methyl-2-(4-pyrimidin-5-ylphenyl)-1,3-oxazol-4-yl]ethoxy]phenyl]propanoic acid Openeye Name: 3-[2-methyl-4-[2-[5-methyl-2-(4-pyrimidin-5-ylphenyl)oxazol-4-yl]ethoxy]phenyl]propanoic acid CAS Name: 3-[2-methyl-4-[2-[5-methyl-2-[4-(5-pyrimidinyl)phenyl]-4-oxazolyl]ethoxy]phenyl]propanoic acid IUPAC Name: 3-[2-methyl-4-[2-[5-methyl-2-(4-pyrimidin-5-ylphenyl)-1,3-oxazol-4-yl]ethoxy]phenyl]propanoic acid Traditional Name: 3-[2-methyl-4-[2-[5-methyl-2-[4-(5-pyrimidyl)phenyl]oxazol-4-yl]ethoxy]phenyl]propionic acid Formula: C26H25N3O4 MolecularWeight: 443.4944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCC2=C(OC(=N2)C3=CC=C(C=C3)C4=CN=CN=C4)C)CCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OCCC2=C(OC(=N2)C3=CC=C(C=C3)C4=CN=CN=C4)C)CCC(=O)O

InChI

InChI=1S/C26H25N3O4/c1-17-13-23(9-7-19(17)8-10-25(30)31)32-12-11-24-18(2)33-26(29-24)21-5-3-20(4-6-21)22-14-27-16-28-15-22/h3-7,9,13-16H,8,10-12H2,1-2H3,(H,30,31)