2-[(1-hexadecoxy-3-phenylmethoxy-propan-2-yl)oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[(1-hexadecoxy-3-phenylmethoxy-propan-2-yl)oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[1-(benzyloxymethyl)-2-hexadecoxy-ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[(1-hexadecoxy-3-phenylmethoxypropan-2-yl)oxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[(1-hexadecoxy-3-phenylmethoxypropan-2-yl)oxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[1-(benzoxymethyl)-2-cetyloxy-ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C31H59NO6P+ MolecularWeight: 572.777021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COCC1=CC=CC=C1)OP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COCC1=CC=CC=C1)OP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C31H58NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25-35-28-31(29-36-27-30-22-19-18-20-23-30)38-39(33,34)37-26-24-32(2,3)4/h18-20,22-23,31H,5-17,21,24-29H2,1-4H3/p+1