[2-(diethylamino)-1-phenyl-ethyl] benzoate; diethyl sulfate

Systemtic Name: [2-(diethylamino)-1-phenyl-ethyl] benzoate; diethyl sulfate Openeye Name: [2-(diethylamino)-1-phenyl-ethyl] benzoate; diethyl sulfate CAS Name: benzoic acid [2-(diethylamino)-1-phenylethyl] ester; sulfuric acid diethyl ester IUPAC Name: [2-(diethylamino)-1-phenylethyl] benzoate; diethyl sulfate Traditional Name: benzoic acid [2-(diethylamino)-1-phenyl-ethyl] ester; sulfuric acid diethyl ester Formula: C23H33NO6S MolecularWeight: 451.57622

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(C1=CC=CC=C1)OC(=O)C2=CC=CC=C2.CCOS(=O)(=O)OCC

Isomeric SMILES

CCN(CC)CC(C1=CC=CC=C1)OC(=O)C2=CC=CC=C2.CCOS(=O)(=O)OCC

InChI

InChI=1S/C19H23NO2.C4H10O4S/c1-3-20(4-2)15-18(16-11-7-5-8-12-16)22-19(21)17-13-9-6-10-14-17;1-3-7-9(5,6)8-4-2/h5-14,18H,3-4,15H2,1-2H3;3-4H2,1-2H3