3-[octadecyl(phenylmethoxycarbonyl)amino]propyl 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: 3-[octadecyl(phenylmethoxycarbonyl)amino]propyl 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: 3-[benzyloxycarbonyl(octadecyl)amino]propyl 2-(trimethylammonio)ethyl phosphate CAS Name: 3-[octadecyl(phenylmethoxycarbonyl)amino]propyl 2-(trimethylammonio)ethyl phosphate IUPAC Name: 3-[octadecyl(phenylmethoxycarbonyl)amino]propyl 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: 3-[carbobenzoxy(stearyl)amino]propyl 2-(trimethylammonio)ethyl phosphate Formula: C34H63N2O6P MolecularWeight: 626.847581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CCCOP(=O)([O-])OCC[N+](C)(C)C)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CCCOP(=O)([O-])OCC[N+](C)(C)C)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C34H63N2O6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-27-35(34(37)40-32-33-25-21-20-22-26-33)28-24-30-41-43(38,39)42-31-29-36(2,3)4/h20-22,25-26H,5-19,23-24,27-32H2,1-4H3