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

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl (3S)-1-(2-fluorophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (7-methoxy-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-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-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 (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C22H18FNO6 MolecularWeight: 411.379823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3CC(=O)N(C3)C4=CC=CC=C4F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)[C@H]3CC(=O)N(C3)C4=CC=CC=C4F

InChI

InChI=1S/C22H18FNO6/c1-28-15-6-7-16-14(9-21(26)30-19(16)10-15)12-29-22(27)13-8-20(25)24(11-13)18-5-3-2-4-17(18)23/h2-7,9-10,13H,8,11-12H2,1H3/t13-/m0/s1