[1-(2-acetyloxy-3-phenylsulfanyl-propyl)-2,2,6,6-tetramethyl-piperidin-4-yl] benzoate

Systemtic Name: [1-(2-acetyloxy-3-phenylsulfanyl-propyl)-2,2,6,6-tetramethyl-piperidin-4-yl] benzoate Openeye Name: [1-(2-acetoxy-3-phenylsulfanyl-propyl)-2,2,6,6-tetramethyl-4-piperidyl] benzoate CAS Name: benzoic acid [1-[2-acetyloxy-3-(phenylthio)propyl]-2,2,6,6-tetramethyl-4-piperidinyl] ester IUPAC Name: [1-(2-acetyloxy-3-phenylsulfanylpropyl)-2,2,6,6-tetramethylpiperidin-4-yl] benzoate Traditional Name: benzoic acid [1-[2-acetoxy-3-(phenylthio)propyl]-2,2,6,6-tetramethyl-4-piperidyl] ester Formula: C27H35NO4S MolecularWeight: 469.6361

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CN1C(CC(CC1(C)C)OC(=O)C2=CC=CC=C2)(C)C)CSC3=CC=CC=C3

Isomeric SMILES

CC(=O)OC(CN1C(CC(CC1(C)C)OC(=O)C2=CC=CC=C2)(C)C)CSC3=CC=CC=C3

InChI

InChI=1S/C27H35NO4S/c1-20(29)31-23(19-33-24-14-10-7-11-15-24)18-28-26(2,3)16-22(17-27(28,4)5)32-25(30)21-12-8-6-9-13-21/h6-15,22-23H,16-19H2,1-5H3