[1-(phenylcarbonyl)-4-(pyridin-2-ylmethylcarbamoyloxymethyl)azetidin-2-yl]methyl N-octadecylcarbamate

Systemtic Name: [1-(phenylcarbonyl)-4-(pyridin-2-ylmethylcarbamoyloxymethyl)azetidin-2-yl]methyl N-octadecylcarbamate Openeye Name: [1-benzoyl-4-(2-pyridylmethylcarbamoyloxymethyl)azetidin-2-yl]methyl N-octadecylcarbamate CAS Name: N-octadecylcarbamic acid [1-benzoyl-4-[[oxo-(2-pyridinylmethylamino)methoxy]methyl]-2-azetidinyl]methyl ester IUPAC Name: [1-benzoyl-4-(pyridin-2-ylmethylcarbamoyloxymethyl)azetidin-2-yl]methyl N-octadecylcarbamate Traditional Name: N-(2-pyridylmethyl)carbamic acid [1-benzoyl-4-(stearylcarbamoyloxymethyl)azetidin-2-yl]methyl ester Formula: C38H58N4O5 MolecularWeight: 650.89092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC1CC(N1C(=O)C2=CC=CC=C2)COC(=O)NCC3=CC=CC=N3

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC1CC(N1C(=O)C2=CC=CC=C2)COC(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C38H58N4O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-27-40-37(44)46-30-34-28-35(42(34)36(43)32-23-18-17-19-24-32)31-47-38(45)41-29-33-25-20-22-26-39-33/h17-20,22-26,34-35H,2-16,21,27-31H2,1H3,(H,40,44)(H,41,45)