trimethyl-[(2R)-4-oxidanylidene-2-[oxidanyl(pentadecyl)phosphoryl]oxy-4-phenylmethoxy-butyl]azanium

Systemtic Name: trimethyl-[(2R)-4-oxidanylidene-2-[oxidanyl(pentadecyl)phosphoryl]oxy-4-phenylmethoxy-butyl]azanium Openeye Name: [(2R)-4-benzyloxy-2-[hydroxy(pentadecyl)phosphoryl]oxy-4-oxo-butyl]-trimethyl-ammonium CAS Name: [(2R)-2-[hydroxy(pentadecyl)phosphoryl]oxy-4-oxo-4-phenylmethoxybutyl]-trimethylammonium IUPAC Name: [(2R)-2-[hydroxy(pentadecyl)phosphoryl]oxy-4-oxo-4-phenylmethoxybutyl]-trimethylazanium Traditional Name: [(2R)-4-benzoxy-2-[hydroxy(pentadecyl)phosphoryl]oxy-4-keto-butyl]-trimethyl-ammonium Formula: C29H53NO5P+ MolecularWeight: 526.708581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCP(=O)(O)OC(CC(=O)OCC1=CC=CC=C1)C[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCP(=O)(O)O[C@H](CC(=O)OCC1=CC=CC=C1)C[N+](C)(C)C

InChI

InChI=1S/C29H52NO5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-20-23-36(32,33)35-28(25-30(2,3)4)24-29(31)34-26-27-21-18-17-19-22-27/h17-19,21-22,28H,5-16,20,23-26H2,1-4H3/p+1/t28-/m1/s1