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

Systemtic Name: ethyl (2R,3R)-3-fluoranyl-4-oxidanylidene-2-(4-phenylmethoxyphenyl)-2H-chromene-3-carboxylate Openeye Name: ethyl (2R,3R)-2-(4-benzyloxyphenyl)-3-fluoro-4-oxo-chromane-3-carboxylate CAS Name: (2R,3R)-3-fluoro-4-oxo-2-(4-phenylmethoxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R)-3-fluoro-4-oxo-2-(4-phenylmethoxyphenyl)-2H-chromene-3-carboxylate Traditional Name: (2R,3R)-2-(4-benzoxyphenyl)-3-fluoro-4-keto-chroman-3-carboxylic acid ethyl ester Formula: C25H21FO5 MolecularWeight: 420.429643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(OC2=CC=CC=C2C1=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)F

Isomeric SMILES

CCOC(=O)[C@]1([C@H](OC2=CC=CC=C2C1=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)F

InChI

InChI=1S/C25H21FO5/c1-2-29-24(28)25(26)22(27)20-10-6-7-11-21(20)31-23(25)18-12-14-19(15-13-18)30-16-17-8-4-3-5-9-17/h3-15,23H,2,16H2,1H3/t23-,25+/m1/s1