[2-(octadecylcarbamoyl)phenyl]methyl N-(2-diethylaminoethyl)carbamate hydrochloride

Systemtic Name: [2-(octadecylcarbamoyl)phenyl]methyl N-(2-diethylaminoethyl)carbamate hydrochloride Openeye Name: [2-(octadecylcarbamoyl)phenyl]methyl N-(2-diethylaminoethyl)carbamate hydrochloride CAS Name: N-(2-diethylaminoethyl)carbamic acid [2-[(octadecylamino)-oxomethyl]phenyl]methyl ester hydrochloride IUPAC Name: [2-(octadecylcarbamoyl)phenyl]methyl N-(2-diethylaminoethyl)carbamate hydrochloride Traditional Name: N-(2-diethylaminoethyl)carbamic acid [2-(stearylcarbamoyl)benzyl] ester hydrochloride Formula: C33H60ClN3O3 MolecularWeight: 582.3008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=CC=C1COC(=O)NCCN(CC)CC.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=CC=C1COC(=O)NCCN(CC)CC.Cl

InChI

InChI=1S/C33H59N3O3.ClH/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-26-34-32(37)31-25-22-21-24-30(31)29-39-33(38)35-27-28-36(5-2)6-3;/h21-22,24-25H,4-20,23,26-29H2,1-3H3,(H,34,37)(H,35,38);1H