(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (3S)-1-(2-fluorophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (3S)-1-(2-fluorophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl (3S)-1-(2-fluorophenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2-fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl (3S)-1-(2-fluorophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2-fluorophenyl)-5-keto-pyrrolidine-3-carboxylic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C21H16FNO6 MolecularWeight: 397.353243

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=CC=C2F)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

C1[C@@H](CN(C1=O)C2=CC=CC=C2F)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C21H16FNO6/c22-16-3-1-2-4-17(16)23-10-12(7-19(23)25)21(27)28-11-13-8-20(26)29-18-9-14(24)5-6-15(13)18/h1-6,8-9,12,24H,7,10-11H2/t12-/m0/s1