3-[3-[(4-chlorophenyl)sulfonylmethyl]-1,2,4-oxadiazol-5-yl]propanoic acid

Systemtic Name: 3-[3-[(4-chlorophenyl)sulfonylmethyl]-1,2,4-oxadiazol-5-yl]propanoic acid Openeye Name: 3-[3-[(4-chlorophenyl)sulfonylmethyl]-1,2,4-oxadiazol-5-yl]propanoic acid CAS Name: 3-[3-[(4-chlorophenyl)sulfonylmethyl]-1,2,4-oxadiazol-5-yl]propanoic acid IUPAC Name: 3-[3-[(4-chlorophenyl)sulfonylmethyl]-1,2,4-oxadiazol-5-yl]propanoic acid Traditional Name: 3-[3-[(4-chlorophenyl)sulfonylmethyl]-1,2,4-oxadiazol-5-yl]propionic acid Formula: C12H11ClN2O5S MolecularWeight: 330.74414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)CC2=NOC(=N2)CCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)CC2=NOC(=N2)CCC(=O)O)Cl

InChI

InChI=1S/C12H11ClN2O5S/c13-8-1-3-9(4-2-8)21(18,19)7-10-14-11(20-15-10)5-6-12(16)17/h1-4H,5-7H2,(H,16,17)