calcium; butanedioic acid; propanoate; heptahydrate

Systemtic Name: calcium; butanedioic acid; propanoate; heptahydrate Openeye Name: calcium; propanoate; succinic acid; heptahydrate CAS Name: calcium; butanedioic acid; propanoate; heptahydrate IUPAC Name: calcium; butanedioic acid; propanoate; heptahydrate Traditional Name: calcium; propionate; succinic acid; heptahydrate Formula: C10H30CaO15 MolecularWeight: 430.4142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H6O4.2C3H6O2.Ca.7H2O/c5-3(6)1-2-4(7)8;2*1-2-3(4)5;;;;;;;;/h1-2H2,(H,5,6)(H,7,8);2*2H2,1H3,(H,4,5);;7*1H2/q;;;+2;;;;;;;/p-2