2-[(3-hexadecoxy-3-methyl-2-phenylmethoxy-butoxy)-oxidanyl-phosphanyl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[(3-hexadecoxy-3-methyl-2-phenylmethoxy-butoxy)-oxidanyl-phosphanyl]oxyethyl-trimethyl-azanium Openeye Name: 2-[(2-benzyloxy-3-hexadecoxy-3-methyl-butoxy)-hydroxy-phosphanyl]oxyethyl-trimethyl-ammonium CAS Name: 2-[(3-hexadecoxy-3-methyl-2-phenylmethoxybutoxy)-hydroxyphosphino]oxyethyl-trimethylammonium IUPAC Name: 2-[(3-hexadecoxy-3-methyl-2-phenylmethoxybutoxy)-hydroxyphosphanyl]oxyethyl-trimethylazanium Traditional Name: 2-[(2-benzoxy-3-cetyloxy-3-methyl-butoxy)-hydroxy-phosphino]oxyethyl-trimethyl-ammonium Formula: C33H63NO5P+ MolecularWeight: 584.830781

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(C)(C)C(COP(O)OCC[N+](C)(C)C)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(C)(C)C(COP(O)OCC[N+](C)(C)C)OCC1=CC=CC=C1

InChI

InChI=1S/C33H63NO5P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-23-27-37-33(2,3)32(36-29-31-24-21-20-22-25-31)30-39-40(35)38-28-26-34(4,5)6/h20-22,24-25,32,35H,7-19,23,26-30H2,1-6H3/q+1