(5-oxidanylidenepyrrolidin-3-yl) 3-(4-phenoxyphenyl)propane-1-sulfonate

Systemtic Name: (5-oxidanylidenepyrrolidin-3-yl) 3-(4-phenoxyphenyl)propane-1-sulfonate Openeye Name: (5-oxopyrrolidin-3-yl) 3-(4-phenoxyphenyl)propane-1-sulfonate CAS Name: 3-(4-phenoxyphenyl)-1-propanesulfonic acid IUPAC Name: (5-oxopyrrolidin-3-yl) 3-(4-phenoxyphenyl)propane-1-sulfonate Traditional Name: 3-(4-phenoxyphenyl)propane-1-sulfonic acid (5-ketopyrrolidin-3-yl) ester Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1=O)OS(=O)(=O)CCCC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C1C(CNC1=O)OS(=O)(=O)CCCC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C19H21NO5S/c21-19-13-18(14-20-19)25-26(22,23)12-4-5-15-8-10-17(11-9-15)24-16-6-2-1-3-7-16/h1-3,6-11,18H,4-5,12-14H2,(H,20,21)