[2-ethoxy-3-[oxidanyl-[3-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-propyl] N-hexadecylcarbamate

Systemtic Name: [2-ethoxy-3-[oxidanyl-[3-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-propyl] N-hexadecylcarbamate Openeye Name: [2-ethoxy-3-[hydroxy-[3-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-propyl] N-hexadecylcarbamate CAS Name: N-hexadecylcarbamic acid [2-ethoxy-3-[hydroxy-[3-(1-pyridin-1-iumylmethyl)phenoxy]phosphino]oxypropyl] ester IUPAC Name: [2-ethoxy-3-[hydroxy-[3-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxypropyl] N-hexadecylcarbamate Traditional Name: N-cetylcarbamic acid [2-ethoxy-3-[hydroxy-[3-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphino]oxy-propyl] ester Formula: C34H56N2O6P+ MolecularWeight: 619.792001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)OCC(COP(O)OC1=CC=CC(=C1)C[N+]2=CC=CC=C2)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)OCC(COP(O)OC1=CC=CC(=C1)C[N+]2=CC=CC=C2)OCC

InChI

InChI=1S/C34H55N2O6P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-24-35-34(37)40-29-33(39-4-2)30-41-43(38)42-32-23-21-22-31(27-32)28-36-25-19-17-20-26-36/h17,19-23,25-27,33,38H,3-16,18,24,28-30H2,1-2H3/p+1