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

Systemtic Name: 3-[[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propanoate Openeye Name: 3-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylpropanoate CAS Name: 3-[[1-(4-methoxyphenyl)-5-tetrazolyl]thio]propanoate IUPAC Name: 3-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylpropanoate Traditional Name: 3-[[1-(4-methoxyphenyl)tetrazol-5-yl]thio]propionate Formula: C11H11N4O3S- MolecularWeight: 279.29504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=N2)SCCC(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=N2)SCCC(=O)[O-]

InChI

InChI=1S/C11H12N4O3S/c1-18-9-4-2-8(3-5-9)15-11(12-13-14-15)19-7-6-10(16)17/h2-5H,6-7H2,1H3,(H,16,17)/p-1