2-[bis(1-oxidanyltetracosan-3-yl)amino]-2-(trimethylazaniumyl)ethanoate

Systemtic Name: 2-[bis(1-oxidanyltetracosan-3-yl)amino]-2-(trimethylazaniumyl)ethanoate Openeye Name: 2-[bis[1-(2-hydroxyethyl)docosyl]amino]-2-(trimethylammonio)acetate CAS Name: 2-[bis(1-hydroxytetracosan-3-yl)amino]-2-(trimethylammonio)acetate IUPAC Name: 2-[bis(1-hydroxytetracosan-3-yl)amino]-2-(trimethylazaniumyl)acetate Traditional Name: 2-[bis[1-(2-hydroxyethyl)docosyl]amino]-2-(trimethylammonio)acetate Formula: C53H108N2O4 MolecularWeight: 837.43562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(CCO)N(C(CCCCCCCCCCCCCCCCCCCCC)CCO)C(C(=O)[O-])[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(CCO)N(C(CCCCCCCCCCCCCCCCCCCCC)CCO)C(C(=O)[O-])[N+](C)(C)C

InChI

InChI=1S/C53H108N2O4/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-44-50(46-48-56)54(52(53(58)59)55(3,4)5)51(47-49-57)45-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h50-52,56-57H,6-49H2,1-5H3