3-[[1-(4-oxidanylcyclohexyl)-1,2,3,4-tetrazol-5-yl]methylsulfanyl]propanoic acid

Systemtic Name: 3-[[1-(4-oxidanylcyclohexyl)-1,2,3,4-tetrazol-5-yl]methylsulfanyl]propanoic acid Openeye Name: 3-[[1-(4-hydroxycyclohexyl)tetrazol-5-yl]methylsulfanyl]propanoic acid CAS Name: 3-[[1-(4-hydroxycyclohexyl)-5-tetrazolyl]methylthio]propanoic acid IUPAC Name: 3-[[1-(4-hydroxycyclohexyl)tetrazol-5-yl]methylsulfanyl]propanoic acid Traditional Name: 3-[[1-(4-hydroxycyclohexyl)tetrazol-5-yl]methylthio]propionic acid Formula: C11H18N4O3S MolecularWeight: 286.35062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N2C(=NN=N2)CSCCC(=O)O)O

Isomeric SMILES

C1CC(CCC1N2C(=NN=N2)CSCCC(=O)O)O

InChI

InChI=1S/C11H18N4O3S/c16-9-3-1-8(2-4-9)15-10(12-13-14-15)7-19-6-5-11(17)18/h8-9,16H,1-7H2,(H,17,18)