barium(2+); [3-methylbut-3-enoxy(oxidanidyl)phosphoryl] phosphate

Systemtic Name: barium(2+); [3-methylbut-3-enoxy(oxidanidyl)phosphoryl] phosphate Openeye Name: barium(2+); [3-methylbut-3-enoxy(oxido)phosphoryl] phosphate CAS Name: barium(2+); [3-methylbut-3-enoxy(oxido)phosphoryl] phosphate IUPAC Name: barium(2+); [3-methylbut-3-enoxy(oxido)phosphoryl] phosphate Traditional Name: barium(2+); [3-methylbut-3-enoxy(oxido)phosphoryl] phosphate Formula: C10H18Ba3O14P4 MolecularWeight: 898.117564

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CCOP(=O)([O-])OP(=O)([O-])[O-].CC(=C)CCOP(=O)([O-])OP(=O)([O-])[O-].[Ba+2].[Ba+2].[Ba+2]

Isomeric SMILES

CC(=C)CCOP(=O)([O-])OP(=O)([O-])[O-].CC(=C)CCOP(=O)([O-])OP(=O)([O-])[O-].[Ba+2].[Ba+2].[Ba+2]

InChI

InChI=1S/2C5H12O7P2.3Ba/c2*1-5(2)3-4-11-14(9,10)12-13(6,7)8;;;/h2*1,3-4H2,2H3,(H,9,10)(H2,6,7,8);;;/q;;3*+2/p-6