2-(acetyloxymethyl)icosyl 1-(trimethylazaniumyl)butyl phosphate

Systemtic Name: 2-(acetyloxymethyl)icosyl 1-(trimethylazaniumyl)butyl phosphate Openeye Name: 2-(acetoxymethyl)icosyl 1-(trimethylammonio)butyl phosphate CAS Name: 2-(acetyloxymethyl)eicosyl 1-(trimethylammonio)butyl phosphate IUPAC Name: 2-(acetyloxymethyl)icosyl 1-(trimethylazaniumyl)butyl phosphate Traditional Name: 2-(acetoxymethyl)eicosyl 1-(trimethylammonio)butyl phosphate Formula: C30H62NO6P MolecularWeight: 563.790141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(COC(=O)C)COP(=O)([O-])OC(CCC)[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(COC(=O)C)COP(=O)([O-])OC(CCC)[N+](C)(C)C

InChI

InChI=1S/C30H62NO6P/c1-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-29(26-35-28(3)32)27-36-38(33,34)37-30(24-8-2)31(4,5)6/h29-30H,7-27H2,1-6H3