1-[4-(5-ethyl-1,2,4-oxadiazol-3-yl)phenyl]sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-[4-(5-ethyl-1,2,4-oxadiazol-3-yl)phenyl]sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-[4-(5-ethyl-1,2,4-oxadiazol-3-yl)phenyl]sulfonylpiperidine-4-carboxylic acid CAS Name: 1-[4-(5-ethyl-1,2,4-oxadiazol-3-yl)phenyl]sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 1-[4-(5-ethyl-1,2,4-oxadiazol-3-yl)phenyl]sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-[4-(5-ethyl-1,2,4-oxadiazol-3-yl)phenyl]sulfonylisonipecotic acid Formula: C16H19N3O5S MolecularWeight: 365.40416

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NO1)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)O

Isomeric SMILES

CCC1=NC(=NO1)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C16H19N3O5S/c1-2-14-17-15(18-24-14)11-3-5-13(6-4-11)25(22,23)19-9-7-12(8-10-19)16(20)21/h3-6,12H,2,7-10H2,1H3,(H,20,21)