2-[[5-(4-butoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NN=C(O2)SCC(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NN=C(O2)SCC(=O)O

InChI

InChI=1S/C14H16N2O4S/c1-2-3-8-19-11-6-4-10(5-7-11)13-15-16-14(20-13)21-9-12(17)18/h4-7H,2-3,8-9H2,1H3,(H,17,18)