calcium 5-(4-chlorophenyl)-2-oxidanylidene-pentanoate

Systemtic Name: calcium 5-(4-chlorophenyl)-2-oxidanylidene-pentanoate Openeye Name: calcium 5-(4-chlorophenyl)-2-oxo-pentanoate CAS Name: calcium 5-(4-chlorophenyl)-2-oxopentanoate IUPAC Name: calcium 5-(4-chlorophenyl)-2-oxopentanoate Traditional Name: calcium 5-(4-chlorophenyl)-2-keto-valerate Formula: C11H10CaClO3+ MolecularWeight: 265.7263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCC(=O)C(=O)[O-])Cl.[Ca+2]

Isomeric SMILES

C1=CC(=CC=C1CCCC(=O)C(=O)[O-])Cl.[Ca+2]

InChI

InChI=1S/C11H11ClO3.Ca/c12-9-6-4-8(5-7-9)2-1-3-10(13)11(14)15;/h4-7H,1-3H2,(H,14,15);/q;+2/p-1