[1-ethanoyl-3-(pyridin-2-ylmethylcarbamoyloxymethyl)azetidin-3-yl]methyl N-octadecylcarbamate

Systemtic Name: [1-ethanoyl-3-(pyridin-2-ylmethylcarbamoyloxymethyl)azetidin-3-yl]methyl N-octadecylcarbamate Openeye Name: [1-acetyl-3-(2-pyridylmethylcarbamoyloxymethyl)azetidin-3-yl]methyl N-octadecylcarbamate CAS Name: N-octadecylcarbamic acid [1-acetyl-3-[[oxo-(2-pyridinylmethylamino)methoxy]methyl]-3-azetidinyl]methyl ester IUPAC Name: [1-acetyl-3-(pyridin-2-ylmethylcarbamoyloxymethyl)azetidin-3-yl]methyl N-octadecylcarbamate Traditional Name: N-(2-pyridylmethyl)carbamic acid [1-acetyl-3-(stearylcarbamoyloxymethyl)azetidin-3-yl]methyl ester Formula: C33H56N4O5 MolecularWeight: 588.82154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CN(C1)C(=O)C)COC(=O)NCC2=CC=CC=N2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CN(C1)C(=O)C)COC(=O)NCC2=CC=CC=N2

InChI

InChI=1S/C33H56N4O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-23-35-31(39)41-27-33(25-37(26-33)29(2)38)28-42-32(40)36-24-30-21-18-20-22-34-30/h18,20-22H,3-17,19,23-28H2,1-2H3,(H,35,39)(H,36,40)