[1-(dibutylamino)-3-propanoyloxy-propan-2-yl] benzoate hydrochloride

Systemtic Name: [1-(dibutylamino)-3-propanoyloxy-propan-2-yl] benzoate hydrochloride Openeye Name: [1-[(dibutylamino)methyl]-2-propanoyloxy-ethyl] benzoate hydrochloride CAS Name: benzoic acid [1-(dibutylamino)-3-(1-oxopropoxy)propan-2-yl] ester hydrochloride IUPAC Name: [1-(dibutylamino)-3-propanoyloxypropan-2-yl] benzoate hydrochloride Traditional Name: benzoic acid [1-[(dibutylamino)methyl]-2-propionyloxy-ethyl] ester hydrochloride Formula: C21H34ClNO4 MolecularWeight: 399.95196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC(COC(=O)CC)OC(=O)C1=CC=CC=C1.Cl

Isomeric SMILES

CCCCN(CCCC)CC(COC(=O)CC)OC(=O)C1=CC=CC=C1.Cl

InChI

InChI=1S/C21H33NO4.ClH/c1-4-7-14-22(15-8-5-2)16-19(17-25-20(23)6-3)26-21(24)18-12-10-9-11-13-18;/h9-13,19H,4-8,14-17H2,1-3H3;1H