3-chloranylpropanoic acid; 4-(methylamino)-1,1-bis(oxidanylidene)thiolan-3-ol

Systemtic Name: 3-chloranylpropanoic acid; 4-(methylamino)-1,1-bis(oxidanylidene)thiolan-3-ol Openeye Name: 3-chloropropanoic acid; 4-(methylamino)-1,1-dioxo-thiolan-3-ol CAS Name: 3-chloropropanoic acid; 4-(methylamino)-1,1-dioxo-3-thiolanol IUPAC Name: 3-chloropropanoic acid; 4-(methylamino)-1,1-dioxothiolan-3-ol Traditional Name: 3-chloropropionic acid; 1,1-diketo-4-(methylamino)thiolan-3-ol Formula: C8H16ClNO5S MolecularWeight: 273.73434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1CS(=O)(=O)CC1O.C(CCl)C(=O)O

Isomeric SMILES

CNC1CS(=O)(=O)CC1O.C(CCl)C(=O)O

InChI

InChI=1S/C5H11NO3S.C3H5ClO2/c1-6-4-2-10(8,9)3-5(4)7;4-2-1-3(5)6/h4-7H,2-3H2,1H3;1-2H2,(H,5,6)