5-methyl-3-oxidanylidene-2-[1-(11-oxidanylundecoxy)-2-(trimethylazaniumyl)ethyl]hexanoate

Systemtic Name: 5-methyl-3-oxidanylidene-2-[1-(11-oxidanylundecoxy)-2-(trimethylazaniumyl)ethyl]hexanoate Openeye Name: 2-[1-(11-hydroxyundecoxy)-2-(trimethylammonio)ethyl]-5-methyl-3-oxo-hexanoate CAS Name: 2-[1-(11-hydroxyundecoxy)-2-(trimethylammonio)ethyl]-5-methyl-3-oxohexanoate IUPAC Name: 2-[1-(11-hydroxyundecoxy)-2-(trimethylazaniumyl)ethyl]-5-methyl-3-oxohexanoate Traditional Name: 2-[1-(11-hydroxyundecoxy)-2-(trimethylammonio)ethyl]-3-keto-5-methyl-hexanoate Formula: C23H45NO5 MolecularWeight: 415.6071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C(C(C[N+](C)(C)C)OCCCCCCCCCCCO)C(=O)[O-]

Isomeric SMILES

CC(C)CC(=O)C(C(C[N+](C)(C)C)OCCCCCCCCCCCO)C(=O)[O-]

InChI

InChI=1S/C23H45NO5/c1-19(2)17-20(26)22(23(27)28)21(18-24(3,4)5)29-16-14-12-10-8-6-7-9-11-13-15-25/h19,21-22,25H,6-18H2,1-5H3