disodium 4-azanyl-5-octadecanoyloxy-5-oxidanylidene-pentanoate

Systemtic Name: disodium 4-azanyl-5-octadecanoyloxy-5-oxidanylidene-pentanoate Openeye Name: disodium 4-amino-5-octadecanoyloxy-5-oxo-pentanoate CAS Name: disodium 4-amino-5-oxo-5-(1-oxooctadecoxy)pentanoate IUPAC Name: disodium 4-amino-5-octadecanoyloxy-5-oxopentanoate Traditional Name: disodium 4-amino-5-keto-5-stearoyloxy-valerate Formula: C23H42NNa2O5+ MolecularWeight: 458.56282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H43NO5.2Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(27)29-23(28)20(24)18-19-21(25)26;;/h20H,2-19,24H2,1H3,(H,25,26);;/q;2*+1/p-1