2-[[1-(1-methoxypropan-2-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[1-(1-methoxypropan-2-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoic acid Openeye Name: 2-[1-(2-methoxy-1-methyl-ethyl)tetrazol-5-yl]sulfanylacetic acid CAS Name: 2-[[1-(1-methoxypropan-2-yl)-5-tetrazolyl]thio]acetic acid IUPAC Name: 2-[1-(1-methoxypropan-2-yl)tetrazol-5-yl]sulfanylacetic acid Traditional Name: 2-[[1-(2-methoxy-1-methyl-ethyl)tetrazol-5-yl]thio]acetic acid Formula: C7H12N4O3S MolecularWeight: 232.26018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1C(=NN=N1)SCC(=O)O

Isomeric SMILES

CC(COC)N1C(=NN=N1)SCC(=O)O

InChI

InChI=1S/C7H12N4O3S/c1-5(3-14-2)11-7(8-9-10-11)15-4-6(12)13/h5H,3-4H2,1-2H3,(H,12,13)