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

Systemtic Name: methyl 3-[[1-(4-hydroxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propanoate Openeye Name: methyl 3-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylpropanoate CAS Name: 3-[[1-(4-hydroxyphenyl)-5-tetrazolyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylpropanoate Traditional Name: 3-[[1-(4-hydroxyphenyl)tetrazol-5-yl]thio]propionic acid methyl ester Formula: C11H12N4O3S MolecularWeight: 280.30298

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=NN=NN1C2=CC=C(C=C2)O

Isomeric SMILES

COC(=O)CCSC1=NN=NN1C2=CC=C(C=C2)O

InChI

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