(4-bromanyl-2-fluoranyl-phenyl)methyl (3S)-1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl (3S)-1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl (3S)-1-(2-furylmethyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2-furanylmethyl)-5-oxo-3-pyrrolidinecarboxylic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl (3S)-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2-furfuryl)-5-keto-pyrrolidine-3-carboxylic acid (4-bromo-2-fluoro-benzyl) ester Formula: C17H15BrFNO4 MolecularWeight: 396.207703

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=CC=CO2)C(=O)OCC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1[C@@H](CN(C1=O)CC2=CC=CO2)C(=O)OCC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C17H15BrFNO4/c18-13-4-3-11(15(19)7-13)10-24-17(22)12-6-16(21)20(8-12)9-14-2-1-5-23-14/h1-5,7,12H,6,8-10H2/t12-/m0/s1