calcium 2-azanylethanesulfonate

Systemtic Name: calcium 2-azanylethanesulfonate Openeye Name: calcium 2-aminoethanesulfonate CAS Name: calcium 2-aminoethanesulfonate IUPAC Name: calcium 2-aminoethanesulfonate Traditional Name: calcium 2-aminoethanesulfonate Formula: C4H12CaN2O6S2 MolecularWeight: 288.35588

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Descriptors Computed from Structure

Canonical SMILES:

C(CS(=O)(=O)[O-])N.C(CS(=O)(=O)[O-])N.[Ca+2]

Isomeric SMILES

C(CS(=O)(=O)[O-])N.C(CS(=O)(=O)[O-])N.[Ca+2]

InChI

InChI=1S/2C2H7NO3S.Ca/c2*3-1-2-7(4,5)6;/h2*1-3H2,(H,4,5,6);/q;;+2/p-2