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

Systemtic Name: 3-[5-[5-(3-cyano-4-propan-2-yloxy-phenyl)-1,2,4-oxadiazol-3-yl]indol-1-yl]propanoic acid Openeye Name: 3-[5-[5-(3-cyano-4-isopropoxy-phenyl)-1,2,4-oxadiazol-3-yl]indol-1-yl]propanoic acid CAS Name: 3-[5-[5-(3-cyano-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-3-yl]-1-indolyl]propanoic acid IUPAC Name: 3-[5-[5-(3-cyano-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-3-yl]indol-1-yl]propanoic acid Traditional Name: 3-[5-[5-(3-cyano-4-isopropoxy-phenyl)-1,2,4-oxadiazol-3-yl]indol-1-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)N(C=C4)CCC(=O)O)C#N

Isomeric SMILES

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

InChI

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