[3-[oxidanyl-[4-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-propan-2-yloxy-propyl] N-hexadecylcarbamate

Systemtic Name: [3-[oxidanyl-[4-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-propan-2-yloxy-propyl] N-hexadecylcarbamate Openeye Name: [3-[hydroxy-[4-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-isopropoxy-propyl] N-hexadecylcarbamate CAS Name: N-hexadecylcarbamic acid [3-[hydroxy-[4-(1-pyridin-1-iumylmethyl)phenoxy]phosphino]oxy-2-propan-2-yloxypropyl] ester IUPAC Name: [3-[hydroxy-[4-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphanyl]oxy-2-propan-2-yloxypropyl] N-hexadecylcarbamate Traditional Name: N-cetylcarbamic acid [3-[hydroxy-[4-(pyridin-1-ium-1-ylmethyl)phenoxy]phosphino]oxy-2-isopropoxy-propyl] ester Formula: C35H58N2O6P+ MolecularWeight: 633.818581

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H57N2O6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-25-36-35(38)40-29-34(42-31(2)3)30-41-44(39)43-33-23-21-32(22-24-33)28-37-26-19-17-20-27-37/h17,19-24,26-27,31,34,39H,4-16,18,25,28-30H2,1-3H3/p+1