barium(2+); butoxy-[oxidanyl(phosphonato)methyl]phosphinate

Systemtic Name: barium(2+); butoxy-[oxidanyl(phosphonato)methyl]phosphinate Openeye Name: barium(2+); butoxy-[hydroxy(phosphonato)methyl]phosphinate CAS Name: barium(2+); butoxy-[hydroxy(phosphonato)methyl]phosphinate IUPAC Name: barium(2+); butoxy-[hydroxy(phosphonato)methyl]phosphinate Traditional Name: barium(2+); butoxy-[hydroxy(phosphonato)methyl]phosphinate Formula: C10H22Ba3O14P4 MolecularWeight: 902.149324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOP(=O)(C(O)P(=O)([O-])[O-])[O-].CCCCOP(=O)(C(O)P(=O)([O-])[O-])[O-].[Ba+2].[Ba+2].[Ba+2]

Isomeric SMILES

CCCCOP(=O)(C(O)P(=O)([O-])[O-])[O-].CCCCOP(=O)(C(O)P(=O)([O-])[O-])[O-].[Ba+2].[Ba+2].[Ba+2]

InChI

InChI=1S/2C5H14O7P2.3Ba/c2*1-2-3-4-12-14(10,11)5(6)13(7,8)9;;;/h2*5-6H,2-4H2,1H3,(H,10,11)(H2,7,8,9);;;/q;;3*+2/p-6