3-[1-(triphenylmethyl)piperidin-4-yl]propyl 4-methylbenzenesulfonate

Systemtic Name: 3-[1-(triphenylmethyl)piperidin-4-yl]propyl 4-methylbenzenesulfonate Openeye Name: 3-(1-trityl-4-piperidyl)propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-[1-(triphenylmethyl)-4-piperidinyl]propyl ester IUPAC Name: 3-(1-tritylpiperidin-4-yl)propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-(1-trityl-4-piperidyl)propyl ester Formula: C34H37NO3S MolecularWeight: 539.72748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2CCN(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2CCN(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C34H37NO3S/c1-28-19-21-33(22-20-28)39(36,37)38-27-11-12-29-23-25-35(26-24-29)34(30-13-5-2-6-14-30,31-15-7-3-8-16-31)32-17-9-4-10-18-32/h2-10,13-22,29H,11-12,23-27H2,1H3