ethyl (2R,3R)-2-(3-bromophenyl)-3-fluoranyl-4-oxidanylidene-2H-chromene-3-carboxylate

Systemtic Name: ethyl (2R,3R)-2-(3-bromophenyl)-3-fluoranyl-4-oxidanylidene-2H-chromene-3-carboxylate Openeye Name: ethyl (2R,3R)-2-(3-bromophenyl)-3-fluoro-4-oxo-chromane-3-carboxylate CAS Name: (2R,3R)-2-(3-bromophenyl)-3-fluoro-4-oxo-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R)-2-(3-bromophenyl)-3-fluoro-4-oxo-2H-chromene-3-carboxylate Traditional Name: (2R,3R)-2-(3-bromophenyl)-3-fluoro-4-keto-chroman-3-carboxylic acid ethyl ester Formula: C18H14BrFO4 MolecularWeight: 393.203763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(OC2=CC=CC=C2C1=O)C3=CC(=CC=C3)Br)F

Isomeric SMILES

CCOC(=O)[C@]1([C@H](OC2=CC=CC=C2C1=O)C3=CC(=CC=C3)Br)F

InChI

InChI=1S/C18H14BrFO4/c1-2-23-17(22)18(20)15(21)13-8-3-4-9-14(13)24-16(18)11-6-5-7-12(19)10-11/h3-10,16H,2H2,1H3/t16-,18+/m1/s1