3-[5-[5-(3-ethyl-4-piperidin-1-yl-phenyl)-1,2,4-oxadiazol-3-yl]indazol-1-yl]propanoic acid

Systemtic Name: 3-[5-[5-(3-ethyl-4-piperidin-1-yl-phenyl)-1,2,4-oxadiazol-3-yl]indazol-1-yl]propanoic acid Openeye Name: 3-[5-[5-[3-ethyl-4-(1-piperidyl)phenyl]-1,2,4-oxadiazol-3-yl]indazol-1-yl]propanoic acid CAS Name: 3-[5-[5-[3-ethyl-4-(1-piperidinyl)phenyl]-1,2,4-oxadiazol-3-yl]-1-indazolyl]propanoic acid IUPAC Name: 3-[5-[5-(3-ethyl-4-piperidin-1-ylphenyl)-1,2,4-oxadiazol-3-yl]indazol-1-yl]propanoic acid Traditional Name: 3-[5-[5-(3-ethyl-4-piperidino-phenyl)-1,2,4-oxadiazol-3-yl]indazol-1-yl]propionic acid Formula: C25H27N5O3 MolecularWeight: 445.51358

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C2=NC(=NO2)C3=CC4=C(C=C3)N(N=C4)CCC(=O)O)N5CCCCC5

Isomeric SMILES

CCC1=C(C=CC(=C1)C2=NC(=NO2)C3=CC4=C(C=C3)N(N=C4)CCC(=O)O)N5CCCCC5

InChI

InChI=1S/C25H27N5O3/c1-2-17-14-19(7-8-21(17)29-11-4-3-5-12-29)25-27-24(28-33-25)18-6-9-22-20(15-18)16-26-30(22)13-10-23(31)32/h6-9,14-16H,2-5,10-13H2,1H3,(H,31,32)