3-[3-[4-(4-methanoylpiperidin-1-yl)sulfonylphenyl]-1,2,4-oxadiazol-5-yl]propanoic acid

Systemtic Name: 3-[3-[4-(4-methanoylpiperidin-1-yl)sulfonylphenyl]-1,2,4-oxadiazol-5-yl]propanoic acid Openeye Name: 3-[3-[4-[(4-formyl-1-piperidyl)sulfonyl]phenyl]-1,2,4-oxadiazol-5-yl]propanoic acid CAS Name: 3-[3-[4-[(4-formyl-1-piperidinyl)sulfonyl]phenyl]-1,2,4-oxadiazol-5-yl]propanoic acid IUPAC Name: 3-[3-[4-(4-formylpiperidin-1-yl)sulfonylphenyl]-1,2,4-oxadiazol-5-yl]propanoic acid Traditional Name: 3-[3-[4-(4-formylpiperidino)sulfonylphenyl]-1,2,4-oxadiazol-5-yl]propionic acid Formula: C17H19N3O6S MolecularWeight: 393.41426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C=O)S(=O)(=O)C2=CC=C(C=C2)C3=NOC(=N3)CCC(=O)O

Isomeric SMILES

C1CN(CCC1C=O)S(=O)(=O)C2=CC=C(C=C2)C3=NOC(=N3)CCC(=O)O

InChI

InChI=1S/C17H19N3O6S/c21-11-12-7-9-20(10-8-12)27(24,25)14-3-1-13(2-4-14)17-18-15(26-19-17)5-6-16(22)23/h1-4,11-12H,5-10H2,(H,22,23)