[5-oxidanylidene-1-[[4-(phenylsulfonyl)phenyl]methyl]pyrrolidin-3-yl] methanesulfonate

Systemtic Name: [5-oxidanylidene-1-[[4-(phenylsulfonyl)phenyl]methyl]pyrrolidin-3-yl] methanesulfonate Openeye Name: [1-[[4-(benzenesulfonyl)phenyl]methyl]-5-oxo-pyrrolidin-3-yl] methanesulfonate CAS Name: methanesulfonic acid [1-[[4-(benzenesulfonyl)phenyl]methyl]-5-oxo-3-pyrrolidinyl] ester IUPAC Name: [1-[[4-(benzenesulfonyl)phenyl]methyl]-5-oxopyrrolidin-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [1-(4-besylbenzyl)-5-keto-pyrrolidin-3-yl] ester Formula: C18H19NO6S2 MolecularWeight: 409.47656

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CC(=O)N(C1)CC2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)OC1CC(=O)N(C1)CC2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H19NO6S2/c1-26(21,22)25-15-11-18(20)19(13-15)12-14-7-9-17(10-8-14)27(23,24)16-5-3-2-4-6-16/h2-10,15H,11-13H2,1H3