[3-(docosanoylamino)-1-oxidanyl-1-oxidanylidene-pentan-2-yl]-trimethyl-azanium

Systemtic Name: [3-(docosanoylamino)-1-oxidanyl-1-oxidanylidene-pentan-2-yl]-trimethyl-azanium Openeye Name: [1-carboxy-2-(docosanoylamino)butyl]-trimethyl-ammonium CAS Name: [1-hydroxy-1-oxo-3-(1-oxodocosylamino)pentan-2-yl]-trimethylammonium IUPAC Name: [3-(docosanoylamino)-1-hydroxy-1-oxopentan-2-yl]-trimethylazanium Traditional Name: [1-carboxy-2-(docosanoylamino)butyl]-trimethyl-ammonium Formula: C30H61N2O3+ MolecularWeight: 497.81694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CC)C(C(=O)O)[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CC)C(C(=O)O)[N+](C)(C)C

InChI

InChI=1S/C30H60N2O3/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-28(33)31-27(7-2)29(30(34)35)32(3,4)5/h27,29H,6-26H2,1-5H3,(H-,31,33,34,35)/p+1