2-[1-dodecoxy-2-(trimethylazaniumyl)ethyl]-4-methyl-3-oxidanylidene-pentanoate

Systemtic Name: 2-[1-dodecoxy-2-(trimethylazaniumyl)ethyl]-4-methyl-3-oxidanylidene-pentanoate Openeye Name: 2-[1-dodecoxy-2-(trimethylammonio)ethyl]-4-methyl-3-oxo-pentanoate CAS Name: 2-[1-dodecoxy-2-(trimethylammonio)ethyl]-4-methyl-3-oxopentanoate IUPAC Name: 2-[1-dodecoxy-2-(trimethylazaniumyl)ethyl]-4-methyl-3-oxopentanoate Traditional Name: 3-keto-2-[1-lauryloxy-2-(trimethylammonio)ethyl]-4-methyl-valerate Formula: C23H45NO4 MolecularWeight: 399.6077

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(C[N+](C)(C)C)C(C(=O)C(C)C)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCOC(C[N+](C)(C)C)C(C(=O)C(C)C)C(=O)[O-]

InChI

InChI=1S/C23H45NO4/c1-7-8-9-10-11-12-13-14-15-16-17-28-20(18-24(4,5)6)21(23(26)27)22(25)19(2)3/h19-21H,7-18H2,1-6H3