tricalcium 2-chloroethyloxy-[oxidanyl(phosphonato)methyl]phosphinate

Systemtic Name: tricalcium 2-chloroethyloxy-[oxidanyl(phosphonato)methyl]phosphinate Openeye Name: tricalcium 2-chloroethoxy-[hydroxy(phosphonato)methyl]phosphinate CAS Name: tricalcium 2-chloroethoxy-[hydroxy(phosphonato)methyl]phosphinate IUPAC Name: tricalcium 2-chloroethoxy-[hydroxy(phosphonato)methyl]phosphinate Traditional Name: tricalcium 2-chloroethoxy-[hydroxy(phosphonato)methyl]phosphinate Formula: C6H12Ca3Cl2O14P4 MolecularWeight: 623.186124

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Descriptors Computed from Structure

Canonical SMILES:

C(CCl)OP(=O)(C(O)P(=O)([O-])[O-])[O-].C(CCl)OP(=O)(C(O)P(=O)([O-])[O-])[O-].[Ca+2].[Ca+2].[Ca+2]

Isomeric SMILES

C(CCl)OP(=O)(C(O)P(=O)([O-])[O-])[O-].C(CCl)OP(=O)(C(O)P(=O)([O-])[O-])[O-].[Ca+2].[Ca+2].[Ca+2]

InChI

InChI=1S/2C3H9ClO7P2.3Ca/c2*4-1-2-11-13(9,10)3(5)12(6,7)8;;;/h2*3,5H,1-2H2,(H,9,10)(H2,6,7,8);;;/q;;3*+2/p-6