disodium 4-azanyl-4-oxidanylidene-2-sulfo-butanoate

Systemtic Name: disodium 4-azanyl-4-oxidanylidene-2-sulfo-butanoate Openeye Name: disodium 4-amino-4-oxo-2-sulfo-butanoate CAS Name: disodium 4-amino-4-oxo-2-sulfobutanoate IUPAC Name: disodium 4-amino-4-oxo-2-sulfobutanoate Traditional Name: disodium 4-amino-4-keto-2-sulfo-butyrate Formula: C8H12N2Na2O12S2 MolecularWeight: 438.29662

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(=O)[O-])S(=O)(=O)O)C(=O)N.C(C(C(=O)[O-])S(=O)(=O)O)C(=O)N.[Na+].[Na+]

Isomeric SMILES

C(C(C(=O)[O-])S(=O)(=O)O)C(=O)N.C(C(C(=O)[O-])S(=O)(=O)O)C(=O)N.[Na+].[Na+]

InChI

InChI=1S/2C4H7NO6S.2Na/c2*5-3(6)1-2(4(7)8)12(9,10)11;;/h2*2H,1H2,(H2,5,6)(H,7,8)(H,9,10,11);;/q;;2*+1/p-2