[1-[ethanoyl(phenethyl)amino]-3-hexadecoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [1-[ethanoyl(phenethyl)amino]-3-hexadecoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-[[acetyl(phenethyl)amino]methyl]-2-hexadecoxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-[acetyl(phenethyl)amino]-3-hexadecoxypropan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-[acetyl(phenethyl)amino]-3-hexadecoxypropan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-[[acetyl(phenethyl)amino]methyl]-2-cetyloxy-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C34H63N2O6P MolecularWeight: 626.847581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CN(CCC1=CC=CC=C1)C(=O)C)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CN(CCC1=CC=CC=C1)C(=O)C)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C34H63N2O6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-22-28-40-31-34(42-43(38,39)41-29-27-36(3,4)5)30-35(32(2)37)26-25-33-23-20-19-21-24-33/h19-21,23-24,34H,6-18,22,25-31H2,1-5H3