2-azanyl-3-(1,3-dioxan-4-ylmethylsulfanyl)propanoic acid

Systemtic Name: 2-azanyl-3-(1,3-dioxan-4-ylmethylsulfanyl)propanoic acid Openeye Name: 2-amino-3-(1,3-dioxan-4-ylmethylsulfanyl)propanoic acid CAS Name: 2-amino-3-(1,3-dioxan-4-ylmethylthio)propanoic acid IUPAC Name: 2-amino-3-(1,3-dioxan-4-ylmethylsulfanyl)propanoic acid Traditional Name: 2-amino-3-(1,3-dioxan-4-ylmethylthio)propionic acid Formula: C8H15NO4S MolecularWeight: 221.274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCOC1CSCC(C(=O)O)N

Isomeric SMILES

C1COCOC1CSCC(C(=O)O)N

InChI

InChI=1S/C8H15NO4S/c9-7(8(10)11)4-14-3-6-1-2-12-5-13-6/h6-7H,1-5,9H2,(H,10,11)