disodium 2-[(3-azanyl-4-oxidanylidene-1-sulfonato-azetidin-2-yl)carbonylamino]propanoate

Systemtic Name: disodium 2-[(3-azanyl-4-oxidanylidene-1-sulfonato-azetidin-2-yl)carbonylamino]propanoate Openeye Name: disodium 2-[(3-amino-4-oxo-1-sulfonato-azetidine-2-carbonyl)amino]propanoate CAS Name: disodium 2-[[(3-amino-4-oxo-1-sulfonato-2-azetidinyl)-oxomethyl]amino]propanoate IUPAC Name: disodium 2-[(3-amino-4-oxo-1-sulfonatoazetidine-2-carbonyl)amino]propanoate Traditional Name: disodium 2-[(3-amino-4-keto-1-sulfonato-azetidine-2-carbonyl)amino]propionate Formula: C7H9N3Na2O7S MolecularWeight: 325.2068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)C1C(C(=O)N1S(=O)(=O)[O-])N.[Na+].[Na+]

Isomeric SMILES

CC(C(=O)[O-])NC(=O)C1C(C(=O)N1S(=O)(=O)[O-])N.[Na+].[Na+]

InChI

InChI=1S/C7H11N3O7S.2Na/c1-2(7(13)14)9-5(11)4-3(8)6(12)10(4)18(15,16)17;;/h2-4H,8H2,1H3,(H,9,11)(H,13,14)(H,15,16,17);;/q;2*+1/p-2