calcium 4-methyl-2-oxidanylidene-pentanoate

Systemtic Name: calcium 4-methyl-2-oxidanylidene-pentanoate Openeye Name: calcium 4-methyl-2-oxo-pentanoate CAS Name: calcium 4-methyl-2-oxopentanoate IUPAC Name: calcium 4-methyl-2-oxopentanoate Traditional Name: calcium 2-keto-4-methyl-valerate Formula: C6H9CaO3+ MolecularWeight: 169.21186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H10O3.Ca/c1-4(2)3-5(7)6(8)9;/h4H,3H2,1-2H3,(H,8,9);/q;+2/p-1