3-[7-[5-(3-cyano-4-propan-2-yloxy-phenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-3-yl]propanoic acid

Systemtic Name: 3-[7-[5-(3-cyano-4-propan-2-yloxy-phenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-3-yl]propanoic acid Openeye Name: 3-[7-[5-(3-cyano-4-isopropoxy-phenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-3-yl]propanoic acid CAS Name: 3-[7-[5-(3-cyano-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-3-yl]propanoic acid IUPAC Name: 3-[7-[5-(3-cyano-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-3-yl]propanoic acid Traditional Name: 3-[7-[5-(3-cyano-4-isopropoxy-phenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-3-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=CC=CC4=C3NC=C4CCC(=O)O)C#N

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C2=NC(=NO2)C3=CC=CC4=C3NC=C4CCC(=O)O)C#N

InChI

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