[1-(4-methylphenyl)sulfonyl-5-(4-methylphenyl)sulfonyloxy-pyrrolidin-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [1-(4-methylphenyl)sulfonyl-5-(4-methylphenyl)sulfonyloxy-pyrrolidin-3-yl] 4-methylbenzenesulfonate Openeye Name: [1-(p-tolylsulfonyl)-5-(p-tolylsulfonyloxy)pyrrolidin-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(4-methylphenyl)sulfonyl-5-(4-methylphenyl)sulfonyloxy-3-pyrrolidinyl] ester IUPAC Name: [1-(4-methylphenyl)sulfonyl-5-(4-methylphenyl)sulfonyloxypyrrolidin-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-tosyl-5-tosyloxy-pyrrolidin-3-yl) ester Formula: C25H27NO8S3 MolecularWeight: 565.67878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2OS(=O)(=O)C3=CC=C(C=C3)C)OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2OS(=O)(=O)C3=CC=C(C=C3)C)OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H27NO8S3/c1-18-4-10-22(11-5-18)35(27,28)26-17-21(33-36(29,30)23-12-6-19(2)7-13-23)16-25(26)34-37(31,32)24-14-8-20(3)9-15-24/h4-15,21,25H,16-17H2,1-3H3