3-[5-[5-(3-cyano-4-propan-2-yloxy-phenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-2-yl]propanoic acid

Systemtic Name: 3-[5-[5-(3-cyano-4-propan-2-yloxy-phenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-2-yl]propanoic acid Openeye Name: 3-[5-[5-(3-cyano-4-isopropoxy-phenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-2-yl]propanoic acid CAS Name: 3-[5-[5-(3-cyano-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-2-yl]propanoic acid IUPAC Name: 3-[5-[5-(3-cyano-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-2-yl]propanoic acid Traditional Name: 3-[5-[5-(3-cyano-4-isopropoxy-phenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-2-yl]propionic acid Formula: C23H20N4O4 MolecularWeight: 416.4293

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C2=NC(=NO2)C3=CC4=C(C=C3)NC(=C4)CCC(=O)O)C#N

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C2=NC(=NO2)C3=CC4=C(C=C3)NC(=C4)CCC(=O)O)C#N

InChI

InChI=1S/C23H20N4O4/c1-13(2)30-20-7-4-15(10-17(20)12-24)23-26-22(27-31-23)14-3-6-19-16(9-14)11-18(25-19)5-8-21(28)29/h3-4,6-7,9-11,13,25H,5,8H2,1-2H3,(H,28,29)