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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NOC(=N2)C)S(=O)(=O)N3CCCC(C3)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NOC(=N2)C)S(=O)(=O)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C16H19N3O5S/c1-10-5-6-12(15-17-11(2)24-18-15)8-14(10)25(22,23)19-7-3-4-13(9-19)16(20)21/h5-6,8,13H,3-4,7,9H2,1-2H3,(H,20,21)