trimethyl-[(E)-2-oxidanyl-2-phosphono-tetracos-18-enyl]azanium

Systemtic Name: trimethyl-[(E)-2-oxidanyl-2-phosphono-tetracos-18-enyl]azanium Openeye Name: [(E)-2-hydroxy-2-phosphono-tetracos-18-enyl]-trimethyl-ammonium CAS Name: [(E)-2-hydroxy-2-phosphonotetracos-18-enyl]-trimethylammonium IUPAC Name: [(E)-2-hydroxy-2-phosphonotetracos-18-enyl]-trimethylazanium Traditional Name: [(E)-2-hydroxy-2-phosphono-tetracos-18-enyl]-trimethyl-ammonium Formula: C27H57NO4P+ MolecularWeight: 490.719541

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCCCCCCCCCCCCCCCC(C[N+](C)(C)C)(O)P(=O)(O)O

Isomeric SMILES

CCCCC/C=C/CCCCCCCCCCCCCCCC(C[N+](C)(C)C)(O)P(=O)(O)O

InChI

InChI=1S/C27H56NO4P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-27(29,33(30,31)32)26-28(2,3)4/h9-10,29H,5-8,11-26H2,1-4H3,(H-,30,31,32)/p+1/b10-9+