O1-[2-(4-acetyloxyphenyl)ethyl] O5-(phenylmethyl) 3-(diethylamino)pentanedioate

Systemtic Name: O1-[2-(4-acetyloxyphenyl)ethyl] O5-(phenylmethyl) 3-(diethylamino)pentanedioate Openeye Name: O1-[2-(4-acetoxyphenyl)ethyl] O5-benzyl 3-(diethylamino)pentanedioate CAS Name: 3-(diethylamino)pentanedioic acid O1-[2-(4-acetyloxyphenyl)ethyl] ester O5-(phenylmethyl) ester IUPAC Name: 1-O-[2-(4-acetyloxyphenyl)ethyl] 5-O-benzyl 3-(diethylamino)pentanedioate Traditional Name: 3-(diethylamino)glutaric acid O1-[2-(4-acetoxyphenyl)ethyl] ester O5-benzyl ester Formula: C26H33NO6 MolecularWeight: 455.54332

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CC(=O)OCCC1=CC=C(C=C1)OC(=O)C)CC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCN(CC)C(CC(=O)OCCC1=CC=C(C=C1)OC(=O)C)CC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H33NO6/c1-4-27(5-2)23(18-26(30)32-19-22-9-7-6-8-10-22)17-25(29)31-16-15-21-11-13-24(14-12-21)33-20(3)28/h6-14,23H,4-5,15-19H2,1-3H3