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

Systemtic Name: 3-[5-[5-(3-cyano-4-propan-2-yloxy-phenyl)-1,2,4-oxadiazol-3-yl]indazol-1-yl]propanoic acid Openeye Name: 3-[5-[5-(3-cyano-4-isopropoxy-phenyl)-1,2,4-oxadiazol-3-yl]indazol-1-yl]propanoic acid CAS Name: 3-[5-[5-(3-cyano-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-3-yl]-1-indazolyl]propanoic acid IUPAC Name: 3-[5-[5-(3-cyano-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-3-yl]indazol-1-yl]propanoic acid Traditional Name: 3-[5-[5-(3-cyano-4-isopropoxy-phenyl)-1,2,4-oxadiazol-3-yl]indazol-1-yl]propionic acid Formula: C22H19N5O4 MolecularWeight: 417.41736

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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(N=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(N=C4)CCC(=O)O)C#N

InChI

InChI=1S/C22H19N5O4/c1-13(2)30-19-6-4-15(10-16(19)11-23)22-25-21(26-31-22)14-3-5-18-17(9-14)12-24-27(18)8-7-20(28)29/h3-6,9-10,12-13H,7-8H2,1-2H3,(H,28,29)