(2-hexadecanoyl-3-oxidanylidene-2-phosphonooxy-octadecyl)-trimethyl-azanium

Systemtic Name: (2-hexadecanoyl-3-oxidanylidene-2-phosphonooxy-octadecyl)-trimethyl-azanium Openeye Name: (2-hexadecanoyl-3-oxo-2-phosphonooxy-octadecyl)-trimethyl-ammonium CAS Name: trimethyl-[3-oxo-2-(1-oxohexadecyl)-2-phosphonooxyoctadecyl]ammonium IUPAC Name: (2-hexadecanoyl-3-oxo-2-phosphonooxyoctadecyl)-trimethylazanium Traditional Name: (2-hexadecanoyl-3-keto-2-phosphonooxy-octadecyl)-trimethyl-ammonium Formula: C37H75NO6P+ MolecularWeight: 660.968261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C[N+](C)(C)C)(C(=O)CCCCCCCCCCCCCCC)OP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C[N+](C)(C)C)(C(=O)CCCCCCCCCCCCCCC)OP(=O)(O)O

InChI

InChI=1S/C37H74NO6P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-35(39)37(34-38(3,4)5,44-45(41,42)43)36(40)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h6-34H2,1-5H3,(H-,41,42,43)/p+1