[2-[3-(dimethylamino)propylcarbamoyloxymethyl]-3-(octadecylcarbamoyl)phenyl] ethanoate

Systemtic Name: [2-[3-(dimethylamino)propylcarbamoyloxymethyl]-3-(octadecylcarbamoyl)phenyl] ethanoate Openeye Name: [2-[3-(dimethylamino)propylcarbamoyloxymethyl]-3-(octadecylcarbamoyl)phenyl] acetate CAS Name: acetic acid [2-[[[3-(dimethylamino)propylamino]-oxomethoxy]methyl]-3-[(octadecylamino)-oxomethyl]phenyl] ester IUPAC Name: [2-[3-(dimethylamino)propylcarbamoyloxymethyl]-3-(octadecylcarbamoyl)phenyl] acetate Traditional Name: acetic acid [2-[3-(dimethylamino)propylcarbamoyloxymethyl]-3-(stearylcarbamoyl)phenyl] ester Formula: C34H59N3O5 MolecularWeight: 589.84936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=C(C(=CC=C1)OC(=O)C)COC(=O)NCCCN(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=C(C(=CC=C1)OC(=O)C)COC(=O)NCCCN(C)C

InChI

InChI=1S/C34H59N3O5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-35-33(39)30-23-21-24-32(42-29(2)38)31(30)28-41-34(40)36-26-22-27-37(3)4/h21,23-24H,5-20,22,25-28H2,1-4H3,(H,35,39)(H,36,40)