tricalcium 2-(phosphonatomethylamino)ethanoate

Systemtic Name: tricalcium 2-(phosphonatomethylamino)ethanoate Openeye Name: tricalcium 2-(phosphonatomethylamino)acetate CAS Name: tricalcium 2-(phosphonatomethylamino)acetate IUPAC Name: tricalcium 2-(phosphonatomethylamino)acetate Traditional Name: tricalcium 2-(phosphonatomethylamino)acetate Formula: C6H10Ca3N2O10P2 MolecularWeight: 452.332522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C3H8NO5P.3Ca/c2*5-3(6)1-4-2-10(7,8)9;;;/h2*4H,1-2H2,(H,5,6)(H2,7,8,9);;;/q;;3*+2/p-6