2-[[1-(3,5-dimethoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[1-(3,5-dimethoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: 2-[1-(3,5-dimethoxyphenyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-(3,5-dimethoxyphenyl)-5-tetrazolyl]thio]acetate IUPAC Name: 2-[1-(3,5-dimethoxyphenyl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[[1-(3,5-dimethoxyphenyl)tetrazol-5-yl]thio]acetate Formula: C11H11N4O4S- MolecularWeight: 295.29444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2C(=NN=N2)SCC(=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2C(=NN=N2)SCC(=O)[O-])OC

InChI

InChI=1S/C11H12N4O4S/c1-18-8-3-7(4-9(5-8)19-2)15-11(12-13-14-15)20-6-10(16)17/h3-5H,6H2,1-2H3,(H,16,17)/p-1