2-[2-chloranyl-2-(trimethylazaniumyl)ethyl]-3-oxidanylidene-icosanoate

Systemtic Name: 2-[2-chloranyl-2-(trimethylazaniumyl)ethyl]-3-oxidanylidene-icosanoate Openeye Name: 2-[2-chloro-2-(trimethylammonio)ethyl]-3-oxo-icosanoate CAS Name: 2-[2-chloro-2-(trimethylammonio)ethyl]-3-oxoeicosanoate IUPAC Name: 2-[2-chloro-2-(trimethylazaniumyl)ethyl]-3-oxoicosanoate Traditional Name: 2-[2-chloro-2-(trimethylammonio)ethyl]-3-keto-arachidate Formula: C25H48ClNO3 MolecularWeight: 446.10652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C(CC([N+](C)(C)C)Cl)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C(CC([N+](C)(C)C)Cl)C(=O)[O-]

InChI

InChI=1S/C25H48ClNO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(28)22(25(29)30)21-24(26)27(2,3)4/h22,24H,5-21H2,1-4H3