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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(O1)SCCOC2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCC1=NN=C(O1)SCCOC2=CC=CC=C2C(=O)O

InChI

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