[(E)-1-(trimethylazaniumyl)hexacos-17-en-2-yl] hydrogen phosphate

Systemtic Name: [(E)-1-(trimethylazaniumyl)hexacos-17-en-2-yl] hydrogen phosphate Openeye Name: [(E)-1-[(trimethylammonio)methyl]pentacos-16-enyl] hydrogen phosphate CAS Name: [(E)-1-(trimethylammonio)hexacos-17-en-2-yl] hydrogen phosphate IUPAC Name: [(E)-1-(trimethylazaniumyl)hexacos-17-en-2-yl] hydrogen phosphate Traditional Name: [(E)-1-[(trimethylammonio)methyl]pentacos-16-enyl] hydrogen phosphate Formula: C29H60NO4P MolecularWeight: 517.764761

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCCCCCCC(C[N+](C)(C)C)OP(=O)(O)[O-]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCCCCCCCC(C[N+](C)(C)C)OP(=O)(O)[O-]

InChI

InChI=1S/C29H60NO4P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-29(28-30(2,3)4)34-35(31,32)33/h12-13,29H,5-11,14-28H2,1-4H3,(H-,31,32,33)/b13-12+