sodium 3-azanyl-4-octadecanoyloxy-4-oxidanylidene-butanoate

Systemtic Name: sodium 3-azanyl-4-octadecanoyloxy-4-oxidanylidene-butanoate Openeye Name: sodium 3-amino-4-octadecanoyloxy-4-oxo-butanoate CAS Name: sodium 3-amino-4-oxo-4-(1-oxooctadecoxy)butanoate IUPAC Name: sodium 3-amino-4-octadecanoyloxy-4-oxobutanoate Traditional Name: sodium 3-amino-4-keto-4-stearoyloxy-butyrate Formula: C22H40NNaO5 MolecularWeight: 421.54647

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H41NO5.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(26)28-22(27)19(23)18-20(24)25;/h19H,2-18,23H2,1H3,(H,24,25);/q;+1/p-1