barium(2+); (Z)-4-oxidanylidenepent-2-en-2-olate; hydrate

Systemtic Name: barium(2+); (Z)-4-oxidanylidenepent-2-en-2-olate; hydrate Openeye Name: barium(2+); (Z)-4-oxopent-2-en-2-olate; hydrate CAS Name: barium(2+); (Z)-4-oxo-2-penten-2-olate; hydrate IUPAC Name: barium(2+); (Z)-4-oxopent-2-en-2-olate; hydrate Traditional Name: barium(2+); (Z)-4-ketopent-2-en-2-olate; hydrate Formula: C5H9BaO3+ MolecularWeight: 254.45016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H8O2.Ba.H2O/c1-4(6)3-5(2)7;;/h3,6H,1-2H3;;1H2/q;+2;/p-1/b4-3-;;