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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SC1=NN=NN1C2=CC=C(C=C2)O

Isomeric SMILES

CC(C(=O)OC)SC1=NN=NN1C2=CC=C(C=C2)O

InChI

InChI=1S/C11H12N4O3S/c1-7(10(17)18-2)19-11-12-13-14-15(11)8-3-5-9(16)6-4-8/h3-7,16H,1-2H3