3-ethyl-2-hexadecanoyl-2,3-bis(oxidanyl)-4-oxidanylidene-nonadecanamide; trimethylazanium; chloride

Systemtic Name: 3-ethyl-2-hexadecanoyl-2,3-bis(oxidanyl)-4-oxidanylidene-nonadecanamide; trimethylazanium; chloride Openeye Name: 3-ethyl-2-hexadecanoyl-2,3-dihydroxy-4-oxo-nonadecanamide; trimethylammonium; chloride CAS Name: 3-ethyl-2,3-dihydroxy-4-oxo-2-(1-oxohexadecyl)nonadecanamide; trimethylammonium; chloride IUPAC Name: 3-ethyl-2-hexadecanoyl-2,3-dihydroxy-4-oxononadecanamide; trimethylazanium; chloride Traditional Name: 3-ethyl-2-hexadecanoyl-2,3-dihydroxy-4-keto-nonadecanamide; trimethylammonium; chloride Formula: C40H81ClN2O5 MolecularWeight: 705.53454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(CC)(C(C(=O)CCCCCCCCCCCCCCC)(C(=O)N)O)O.C[NH+](C)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(CC)(C(C(=O)CCCCCCCCCCCCCCC)(C(=O)N)O)O.C[NH+](C)C.[Cl-]

InChI

InChI=1S/C37H71NO5.C3H9N.ClH/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33(39)36(42,6-3)37(43,35(38)41)34(40)32-30-28-26-24-22-20-18-16-14-12-10-8-5-2;1-4(2)3;/h42-43H,4-32H2,1-3H3,(H2,38,41);1-3H3;1H