2-[3-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]propoxy]benzoic acid

Systemtic Name: 2-[3-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]propoxy]benzoic acid Openeye Name: 2-[3-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]propoxy]benzoic acid CAS Name: 2-[3-[(5-ethyl-1,3,4-oxadiazol-2-yl)thio]propoxy]benzoic acid IUPAC Name: 2-[3-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]propoxy]benzoic acid Traditional Name: 2-[3-[(5-ethyl-1,3,4-oxadiazol-2-yl)thio]propoxy]benzoic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(O1)SCCCOC2=CC=CC=C2C(=O)O

Isomeric SMILES

CCC1=NN=C(O1)SCCCOC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C14H16N2O4S/c1-2-12-15-16-14(20-12)21-9-5-8-19-11-7-4-3-6-10(11)13(17)18/h3-4,6-7H,2,5,8-9H2,1H3,(H,17,18)