[1-(octadecylcarbamoyloxymethyl)cyclopropyl]methyl N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate

Systemtic Name: [1-(octadecylcarbamoyloxymethyl)cyclopropyl]methyl N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate Openeye Name: [1-(octadecylcarbamoyloxymethyl)cyclopropyl]methyl N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate CAS Name: N-acetyl-N-[(1-ethyl-2-pyridin-1-iumyl)methyl]carbamic acid [1-[[(octadecylamino)-oxomethoxy]methyl]cyclopropyl]methyl ester IUPAC Name: [1-(octadecylcarbamoyloxymethyl)cyclopropyl]methyl N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate Traditional Name: N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamic acid [1-(stearylcarbamoyloxymethyl)cyclopropyl]methyl ester Formula: C35H60N3O5+ MolecularWeight: 602.868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CC1)COC(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CC1)COC(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C

InChI

InChI=1S/C35H59N3O5/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-26-36-33(40)42-29-35(24-25-35)30-43-34(41)38(31(3)39)28-32-23-20-22-27-37(32)5-2/h20,22-23,27H,4-19,21,24-26,28-30H2,1-3H3/p+1