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

Systemtic Name: [2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-yl] 4-methylbenzenesulfonate Openeye Name: [2,2,6,6-tetramethyl-1-(1-phenylethoxy)-4-piperidyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2,2,6,6-tetramethyl-1-(1-phenylethoxy)-4-piperidinyl] ester IUPAC Name: [2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2,2,6,6-tetramethyl-1-(1-phenylethoxy)-4-piperidyl] ester Formula: C24H33NO4S MolecularWeight: 431.58812

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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)C3=CC=CC=C3)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H33NO4S/c1-18-12-14-22(15-13-18)30(26,27)29-21-16-23(3,4)25(24(5,6)17-21)28-19(2)20-10-8-7-9-11-20/h7-15,19,21H,16-17H2,1-6H3