[(E)-2-acetamido-3-oxidanyl-hex-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(E)-2-acetamido-3-oxidanyl-hex-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(E)-2-acetamido-3-hydroxy-hex-4-enyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(E)-2-acetamido-3-hydroxyhex-4-enyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(E)-2-acetamido-3-hydroxyhex-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(E)-2-acetamido-3-hydroxy-hex-4-enyl] 2-(trimethylammonio)ethyl phosphate Formula: C13H27N2O6P MolecularWeight: 338.337041

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(C(COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)C)O

Isomeric SMILES

C/C=C/C(C(COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)C)O

InChI

InChI=1S/C13H27N2O6P/c1-6-7-13(17)12(14-11(2)16)10-21-22(18,19)20-9-8-15(3,4)5/h6-7,12-13,17H,8-10H2,1-5H3,(H-,14,16,18,19)/b7-6+