2-[[2-(heptadecoxymethyl)-4-oxidanylidene-pentoxy]-oxidanyl-phosphoryl]ethyl-dimethyl-azanium

Systemtic Name: 2-[[2-(heptadecoxymethyl)-4-oxidanylidene-pentoxy]-oxidanyl-phosphoryl]ethyl-dimethyl-azanium Openeye Name: 2-[[2-(heptadecoxymethyl)-4-oxo-pentoxy]-hydroxy-phosphoryl]ethyl-dimethyl-ammonium CAS Name: 2-[[2-(heptadecoxymethyl)-4-oxopentoxy]-hydroxyphosphoryl]ethyl-dimethylammonium IUPAC Name: 2-[[2-(heptadecoxymethyl)-4-oxopentoxy]-hydroxyphosphoryl]ethyl-dimethylazanium Traditional Name: 2-[[2-(heptadecoxymethyl)-4-keto-pentoxy]-hydroxy-phosphoryl]ethyl-dimethyl-ammonium Formula: C27H57NO5P+ MolecularWeight: 506.718941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOCC(CC(=O)C)COP(=O)(CC[NH+](C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCOCC(CC(=O)C)COP(=O)(CC[NH+](C)C)O

InChI

InChI=1S/C27H56NO5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-32-24-27(23-26(2)29)25-33-34(30,31)22-20-28(3)4/h27H,5-25H2,1-4H3,(H,30,31)/p+1