[2,2,6,6-tetramethyl-1-(phenylmethyl)piperidin-4-yl] 4-methylbenzenesulfonate

Systemtic Name: [2,2,6,6-tetramethyl-1-(phenylmethyl)piperidin-4-yl] 4-methylbenzenesulfonate Openeye Name: (1-benzyl-2,2,6,6-tetramethyl-4-piperidyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2,2,6,6-tetramethyl-1-(phenylmethyl)-4-piperidinyl] ester IUPAC Name: (1-benzyl-2,2,6,6-tetramethylpiperidin-4-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-benzyl-2,2,6,6-tetramethyl-4-piperidyl) ester Formula: C23H31NO3S MolecularWeight: 401.56214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(N(C(C2)(C)C)CC3=CC=CC=C3)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(N(C(C2)(C)C)CC3=CC=CC=C3)(C)C

InChI

InChI=1S/C23H31NO3S/c1-18-11-13-21(14-12-18)28(25,26)27-20-15-22(2,3)24(23(4,5)16-20)17-19-9-7-6-8-10-19/h6-14,20H,15-17H2,1-5H3