(1-hexadecoxy-3-phenylazanyl-propan-2-yl) 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: (1-hexadecoxy-3-phenylazanyl-propan-2-yl) 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-(anilinomethyl)-2-hexadecoxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: (1-anilino-3-hexadecoxypropan-2-yl) 2-(trimethylammonio)ethyl phosphate IUPAC Name: (1-anilino-3-hexadecoxypropan-2-yl) 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-(anilinomethyl)-2-cetyloxy-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C30H57N2O5P MolecularWeight: 556.757741

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CNC1=CC=CC=C1)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CNC1=CC=CC=C1)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C30H57N2O5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25-35-28-30(27-31-29-22-19-18-20-23-29)37-38(33,34)36-26-24-32(2,3)4/h18-20,22-23,30-31H,5-17,21,24-28H2,1-4H3