[2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-ethanoyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]carbamate chloride

Systemtic Name: [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-ethanoyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]carbamate chloride Openeye Name: [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-acetyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]carbamate chloride CAS Name: N-acetyl-N-[(1-propyl-2-pyridin-1-iumyl)methyl]carbamic acid [2-methoxy-3-[(octadecylamino)-oxomethoxy]propyl] ester chloride IUPAC Name: [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-acetyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]carbamate chloride Traditional Name: N-acetyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]carbamic acid [2-methoxy-3-(stearylcarbamoyloxy)propyl] ester chloride Formula: C35H62ClN3O6 MolecularWeight: 656.33628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)N(CC1=CC=CC=[N+]1CCC)C(=O)C)OC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)N(CC1=CC=CC=[N+]1CCC)C(=O)C)OC.[Cl-]

InChI

InChI=1S/C35H61N3O6.ClH/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-25-36-34(40)43-29-33(42-4)30-44-35(41)38(31(3)39)28-32-24-21-23-27-37(32)26-6-2;/h21,23-24,27,33H,5-20,22,25-26,28-30H2,1-4H3;1H