[1-(triphenylmethyl)piperidin-4-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [1-(triphenylmethyl)piperidin-4-yl]methyl 4-methylbenzenesulfonate Openeye Name: (1-trityl-4-piperidyl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(triphenylmethyl)-4-piperidinyl]methyl ester IUPAC Name: (1-tritylpiperidin-4-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-trityl-4-piperidyl)methyl ester Formula: C32H33NO3S MolecularWeight: 511.67432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCN(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCN(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H33NO3S/c1-26-17-19-31(20-18-26)37(34,35)36-25-27-21-23-33(24-22-27)32(28-11-5-2-6-12-28,29-13-7-3-8-14-29)30-15-9-4-10-16-30/h2-20,27H,21-25H2,1H3