[1-dodecoxy-3-[(phenylmethyl)amino]propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [1-dodecoxy-3-[(phenylmethyl)amino]propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-[(benzylamino)methyl]-2-dodecoxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-dodecoxy-3-[(phenylmethyl)amino]propan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-(benzylamino)-3-dodecoxypropan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-[(benzylamino)methyl]-2-lauryloxy-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C27H51N2O5P MolecularWeight: 514.678001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCC(CNCC1=CC=CC=C1)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCOCC(CNCC1=CC=CC=C1)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C27H51N2O5P/c1-5-6-7-8-9-10-11-12-13-17-21-32-25-27(24-28-23-26-18-15-14-16-19-26)34-35(30,31)33-22-20-29(2,3)4/h14-16,18-19,27-28H,5-13,17,20-25H2,1-4H3