3-[3-methyl-4-[5-(5-propoxypyridin-2-yl)-1,2,4-oxadiazol-3-yl]phenyl]propanoic acid

Systemtic Name: 3-[3-methyl-4-[5-(5-propoxypyridin-2-yl)-1,2,4-oxadiazol-3-yl]phenyl]propanoic acid Openeye Name: 3-[3-methyl-4-[5-(5-propoxy-2-pyridyl)-1,2,4-oxadiazol-3-yl]phenyl]propanoic acid CAS Name: 3-[3-methyl-4-[5-(5-propoxy-2-pyridinyl)-1,2,4-oxadiazol-3-yl]phenyl]propanoic acid IUPAC Name: 3-[3-methyl-4-[5-(5-propoxypyridin-2-yl)-1,2,4-oxadiazol-3-yl]phenyl]propanoic acid Traditional Name: 3-[3-methyl-4-[5-(5-propoxy-2-pyridyl)-1,2,4-oxadiazol-3-yl]phenyl]propionic acid Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CN=C(C=C1)C2=NC(=NO2)C3=C(C=C(C=C3)CCC(=O)O)C

Isomeric SMILES

CCCOC1=CN=C(C=C1)C2=NC(=NO2)C3=C(C=C(C=C3)CCC(=O)O)C

InChI

InChI=1S/C20H21N3O4/c1-3-10-26-15-6-8-17(21-12-15)20-22-19(23-27-20)16-7-4-14(11-13(16)2)5-9-18(24)25/h4,6-8,11-12H,3,5,9-10H2,1-2H3,(H,24,25)