(2-imidazol-1-yl-3-octadecoxy-propoxy)-[2-(trimethylazaniumyl)ethyl]phosphinate

Systemtic Name: (2-imidazol-1-yl-3-octadecoxy-propoxy)-[2-(trimethylazaniumyl)ethyl]phosphinate Openeye Name: (2-imidazol-1-yl-3-octadecoxy-propoxy)-[2-(trimethylammonio)ethyl]phosphinate CAS Name: [2-(1-imidazolyl)-3-octadecoxypropoxy]-[2-(trimethylammonio)ethyl]phosphinate IUPAC Name: (2-imidazol-1-yl-3-octadecoxypropoxy)-[2-(trimethylazaniumyl)ethyl]phosphinate Traditional Name: (2-imidazol-1-yl-3-stearyloxy-propoxy)-[2-(trimethylammonio)ethyl]phosphinate Formula: C29H58N3O4P MolecularWeight: 543.762281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(CC[N+](C)(C)C)[O-])N1C=CN=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(CC[N+](C)(C)C)[O-])N1C=CN=C1

InChI

InChI=1S/C29H58N3O4P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-35-26-29(31-22-21-30-28-31)27-36-37(33,34)25-23-32(2,3)4/h21-22,28-29H,5-20,23-27H2,1-4H3