disodium 1-azanyl-3-sulfo-propane-2-sulfonate

Systemtic Name: disodium 1-azanyl-3-sulfo-propane-2-sulfonate Openeye Name: disodium 1-amino-3-sulfo-propane-2-sulfonate CAS Name: disodium 1-amino-3-sulfo-2-propanesulfonate IUPAC Name: disodium 1-amino-3-sulfopropane-2-sulfonate Traditional Name: disodium 1-amino-3-sulfo-propane-2-sulfonate Formula: C6H16N2Na2O12S4 MolecularWeight: 482.43698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C3H9NO6S2.2Na/c2*4-1-3(12(8,9)10)2-11(5,6)7;;/h2*3H,1-2,4H2,(H,5,6,7)(H,8,9,10);;/q;;2*+1/p-2