4-(trimethylazaniumyl)-3-[2,2,2-tris(chloranyl)ethanoyloxy]butanoate

Systemtic Name: 4-(trimethylazaniumyl)-3-[2,2,2-tris(chloranyl)ethanoyloxy]butanoate Openeye Name: 3-(2,2,2-trichloroacetyl)oxy-4-(trimethylammonio)butanoate CAS Name: 3-(2,2,2-trichloro-1-oxoethoxy)-4-(trimethylammonio)butanoate IUPAC Name: 3-(2,2,2-trichloroacetyl)oxy-4-(trimethylazaniumyl)butanoate Traditional Name: 3-(2,2,2-trichloroacetyl)oxy-4-(trimethylammonio)butyrate Formula: C9H14Cl3NO4 MolecularWeight: 306.57076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14Cl3NO4/c1-13(2,3)5-6(4-7(14)15)17-8(16)9(10,11)12/h6H,4-5H2,1-3H3