[2-(3-oxidanylidenepropyl)phenyl] N-(3-morpholin-4-ylpropylamino)-N-octadecyl-carbamate hydrochloride

Systemtic Name: [2-(3-oxidanylidenepropyl)phenyl] N-(3-morpholin-4-ylpropylamino)-N-octadecyl-carbamate hydrochloride Openeye Name: [2-(3-oxopropyl)phenyl] N-(3-morpholinopropylamino)-N-octadecyl-carbamate hydrochloride CAS Name: N-[3-(4-morpholinyl)propylamino]-N-octadecylcarbamic acid [2-(3-oxopropyl)phenyl] ester hydrochloride IUPAC Name: [2-(3-oxopropyl)phenyl] N-(3-morpholin-4-ylpropylamino)-N-octadecylcarbamate hydrochloride Traditional Name: N-(3-morpholinopropylamino)-N-stearyl-carbamic acid [2-(3-ketopropyl)phenyl] ester hydrochloride Formula: C35H62ClN3O4 MolecularWeight: 624.33748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C(=O)OC1=CC=CC=C1CCC=O)NCCCN2CCOCC2.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C(=O)OC1=CC=CC=C1CCC=O)NCCCN2CCOCC2.Cl

InChI

InChI=1S/C35H61N3O4.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-27-38(36-25-21-26-37-28-31-41-32-29-37)35(40)42-34-24-18-17-22-33(34)23-20-30-39;/h17-18,22,24,30,36H,2-16,19-21,23,25-29,31-32H2,1H3;1H