calcium 2-(dodecanoylamino)ethanoic acid

Systemtic Name: calcium 2-(dodecanoylamino)ethanoic acid Openeye Name: calcium 2-(dodecanoylamino)acetic acid CAS Name: calcium 2-(1-oxododecylamino)acetic acid IUPAC Name: calcium 2-(dodecanoylamino)acetic acid Traditional Name: calcium 2-(lauroylamino)acetic acid Formula: C14H27CaNO3+2 MolecularWeight: 297.44708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NCC(=O)O.[Ca+2]

Isomeric SMILES

CCCCCCCCCCCC(=O)NCC(=O)O.[Ca+2]

InChI

InChI=1S/C14H27NO3.Ca/c1-2-3-4-5-6-7-8-9-10-11-13(16)15-12-14(17)18;/h2-12H2,1H3,(H,15,16)(H,17,18);/q;+2