[2-(hydroxymethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidin-1-yl] methanesulfonate

Systemtic Name: [2-(hydroxymethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidin-1-yl] methanesulfonate Openeye Name: [2-(hydroxymethyl)-4-tritylsulfanyl-pyrrolidin-1-yl] methanesulfonate CAS Name: methanesulfonic acid [2-(hydroxymethyl)-4-[(triphenylmethyl)thio]-1-pyrrolidinyl] ester IUPAC Name: [2-(hydroxymethyl)-4-tritylsulfanylpyrrolidin-1-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-methylol-4-(tritylthio)pyrrolidino] ester Formula: C25H27NO4S2 MolecularWeight: 469.61618

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)ON1CC(CC1CO)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)ON1CC(CC1CO)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H27NO4S2/c1-32(28,29)30-26-18-24(17-23(26)19-27)31-25(20-11-5-2-6-12-20,21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,23-24,27H,17-19H2,1H3