[2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-ethanoyl-N-[(3-methyl-1,3-thiazol-3-ium-2-yl)methyl]carbamate iodide

Systemtic Name: [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-ethanoyl-N-[(3-methyl-1,3-thiazol-3-ium-2-yl)methyl]carbamate iodide Openeye Name: [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-acetyl-N-[(3-methylthiazol-3-ium-2-yl)methyl]carbamate iodide CAS Name: N-acetyl-N-[(3-methyl-2-thiazol-3-iumyl)methyl]carbamic acid [2-methoxy-3-[(octadecylamino)-oxomethoxy]propyl] ester iodide IUPAC Name: [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-acetyl-N-[(3-methyl-1,3-thiazol-3-ium-2-yl)methyl]carbamate iodide Traditional Name: N-acetyl-N-[(3-methylthiazol-3-ium-2-yl)methyl]carbamic acid [2-methoxy-3-(stearylcarbamoyloxy)propyl] ester iodide Formula: C31H56IN3O6S MolecularWeight: 725.76231

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)N(CC1=[N+](C=CS1)C)C(=O)C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)N(CC1=[N+](C=CS1)C)C(=O)C)OC.[I-]

InChI

InChI=1S/C31H55N3O6S.HI/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32-30(36)39-25-28(38-4)26-40-31(37)34(27(2)35)24-29-33(3)22-23-41-29;/h22-23,28H,5-21,24-26H2,1-4H3;1H