sodium 5-azanyl-2-(octadecanoylamino)-5-oxidanylidene-pentanoate

Systemtic Name: sodium 5-azanyl-2-(octadecanoylamino)-5-oxidanylidene-pentanoate Openeye Name: sodium 5-amino-2-(octadecanoylamino)-5-oxo-pentanoate CAS Name: sodium 5-amino-5-oxo-2-(1-oxooctadecylamino)pentanoate IUPAC Name: sodium 5-amino-2-(octadecanoylamino)-5-oxopentanoate Traditional Name: sodium 5-amino-5-keto-2-stearamido-valerate Formula: C23H43N2NaO4 MolecularWeight: 434.58829

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(CCC(=O)N)C(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC(CCC(=O)N)C(=O)[O-].[Na+]

InChI

InChI=1S/C23H44N2O4.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(27)25-20(23(28)29)18-19-21(24)26;/h20H,2-19H2,1H3,(H2,24,26)(H,25,27)(H,28,29);/q;+1/p-1