[(E)-18-[2-(2-methylpropanoyloxy)propoxy]-18-oxidanylidene-octadec-9-en-4-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(E)-18-[2-(2-methylpropanoyloxy)propoxy]-18-oxidanylidene-octadec-9-en-4-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(E)-15-[2-(2-methylpropanoyloxy)propoxy]-15-oxo-1-propyl-pentadec-6-enyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(E)-18-[2-(2-methyl-1-oxopropoxy)propoxy]-18-oxooctadec-9-en-4-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(E)-18-[2-(2-methylpropanoyloxy)propoxy]-18-oxooctadec-9-en-4-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(E)-15-(2-isobutyryloxypropoxy)-15-keto-1-propyl-pentadec-6-enyl] 2-(trimethylammonio)ethyl phosphate Formula: C30H58NO8P MolecularWeight: 591.757181

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCCCC=CCCCCCCCC(=O)OCC(C)OC(=O)C(C)C)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCC(CCCC/C=C/CCCCCCCC(=O)OCC(C)OC(=O)C(C)C)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C30H58NO8P/c1-8-20-28(39-40(34,35)37-24-23-31(5,6)7)21-18-16-14-12-10-9-11-13-15-17-19-22-29(32)36-25-27(4)38-30(33)26(2)3/h10,12,26-28H,8-9,11,13-25H2,1-7H3/b12-10+