4-[[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]butanoic acid

Systemtic Name: 4-[[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]butanoic acid Openeye Name: 4-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylbutanoic acid CAS Name: 4-[[1-(4-methoxyphenyl)-5-tetrazolyl]thio]butanoic acid IUPAC Name: 4-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylbutanoic acid Traditional Name: 4-[[1-(4-methoxyphenyl)tetrazol-5-yl]thio]butyric acid Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=N2)SCCCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=N2)SCCCC(=O)O

InChI

InChI=1S/C12H14N4O3S/c1-19-10-6-4-9(5-7-10)16-12(13-14-15-16)20-8-2-3-11(17)18/h4-7H,2-3,8H2,1H3,(H,17,18)