[1-[methyl-(phenylmethyl)amino]-3-octadecoxy-propan-2-yl] ethanoate hydrochloride

Systemtic Name: [1-[methyl-(phenylmethyl)amino]-3-octadecoxy-propan-2-yl] ethanoate hydrochloride Openeye Name: [1-[[benzyl(methyl)amino]methyl]-2-octadecoxy-ethyl] acetate hydrochloride CAS Name: acetic acid [1-[methyl-(phenylmethyl)amino]-3-octadecoxypropan-2-yl] ester hydrochloride IUPAC Name: [1-[benzyl(methyl)amino]-3-octadecoxypropan-2-yl] acetate hydrochloride Traditional Name: acetic acid [1-[[benzyl(methyl)amino]methyl]-2-stearyloxy-ethyl] ester hydrochloride Formula: C31H56ClNO3 MolecularWeight: 526.23424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CN(C)CC1=CC=CC=C1)OC(=O)C.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CN(C)CC1=CC=CC=C1)OC(=O)C.Cl

InChI

InChI=1S/C31H55NO3.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-34-28-31(35-29(2)33)27-32(3)26-30-23-20-19-21-24-30;/h19-21,23-24,31H,4-18,22,25-28H2,1-3H3;1H