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

Systemtic Name: [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-[(3-ethyl-1,3-thiazol-3-ium-2-yl)methyl]carbamate iodide Openeye Name: [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-[(3-ethylthiazol-3-ium-2-yl)methyl]carbamate iodide CAS Name: N-[(3-ethyl-2-thiazol-3-iumyl)methyl]carbamic acid [2-methoxy-3-[(octadecylamino)-oxomethoxy]propyl] ester iodide IUPAC Name: [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-[(3-ethyl-1,3-thiazol-3-ium-2-yl)methyl]carbamate iodide Traditional Name: N-[(3-ethylthiazol-3-ium-2-yl)methyl]carbamic acid [2-methoxy-3-(stearylcarbamoyloxy)propyl] ester iodide Formula: C30H56IN3O5S MolecularWeight: 697.75221

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)NCC1=[N+](C=CS1)CC)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)NCC1=[N+](C=CS1)CC)OC.[I-]

InChI

InChI=1S/C30H55N3O5S.HI/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-31-29(34)37-25-27(36-3)26-38-30(35)32-24-28-33(5-2)22-23-39-28;/h22-23,27H,4-21,24-26H2,1-3H3,(H-,31,32,34,35);1H