[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 3-fluoranyl-4-methoxy-benzenesulfonate

Systemtic Name: [4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 3-fluoranyl-4-methoxy-benzenesulfonate Openeye Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 3-fluoro-4-methoxy-benzenesulfonate CAS Name: 3-fluoro-4-methoxybenzenesulfonic acid [4-(2-oxo-1-pyrrolidinyl)phenyl] ester IUPAC Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 3-fluoro-4-methoxybenzenesulfonate Traditional Name: 3-fluoro-4-methoxy-benzenesulfonic acid [4-(2-ketopyrrolidino)phenyl] ester Formula: C17H16FNO5S MolecularWeight: 365.376043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N3CCCC3=O)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N3CCCC3=O)F

InChI

InChI=1S/C17H16FNO5S/c1-23-16-9-8-14(11-15(16)18)25(21,22)24-13-6-4-12(5-7-13)19-10-2-3-17(19)20/h4-9,11H,2-3,10H2,1H3