calcium 4-methylidene-5-oxidanylidene-hexanoate

Systemtic Name: calcium 4-methylidene-5-oxidanylidene-hexanoate Openeye Name: calcium 4-methylene-5-oxo-hexanoate CAS Name: calcium 4-methylene-5-oxohexanoate IUPAC Name: calcium 4-methylidene-5-oxohexanoate Traditional Name: calcium 4-acetylpent-4-enoate Formula: C7H9CaO3+ MolecularWeight: 181.22256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H10O3.Ca/c1-5(6(2)8)3-4-7(9)10;/h1,3-4H2,2H3,(H,9,10);/q;+2/p-1