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

Systemtic Name: [2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidin-4-yl] 4-methylbenzenesulfonate Openeye Name: [2,2,6,6-tetramethyl-1-(1-methyl-1-phenyl-ethoxy)-4-piperidyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)-4-piperidinyl] ester IUPAC Name: [2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidin-4-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-cumyloxy-2,2,6,6-tetramethyl-4-piperidyl) ester Formula: C25H35NO4S MolecularWeight: 445.6147

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35NO4S/c1-19-13-15-22(16-14-19)31(27,28)29-21-17-23(2,3)26(24(4,5)18-21)30-25(6,7)20-11-9-8-10-12-20/h8-16,21H,17-18H2,1-7H3