[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 1-(2-fluorophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 1-(2-fluorophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 1-(2-fluorophenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(2-fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] 1-(2-fluorophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(2-fluorophenyl)-5-keto-pyrrolidine-3-carboxylic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C21H20FNO4S2 MolecularWeight: 433.516203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)C3CC(=O)N(C3)C4=CC=CC=C4F

Isomeric SMILES

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)C3CC(=O)N(C3)C4=CC=CC=C4F

InChI

InChI=1S/C21H20FNO4S2/c1-26-18-10-13(21-28-8-9-29-21)6-7-17(18)27-20(25)14-11-19(24)23(12-14)16-5-3-2-4-15(16)22/h2-7,10,14,21H,8-9,11-12H2,1H3