2-[(2R,4R)-6-cyano-7-fluoranyl-2-methyl-4-oxidanyl-2,3-dihydrochromen-4-yl]ethanoic acid

Systemtic Name: 2-[(2R,4R)-6-cyano-7-fluoranyl-2-methyl-4-oxidanyl-2,3-dihydrochromen-4-yl]ethanoic acid Openeye Name: 2-[(2R,4R)-6-cyano-7-fluoro-4-hydroxy-2-methyl-chroman-4-yl]acetic acid CAS Name: 2-[(2R,4R)-6-cyano-7-fluoro-4-hydroxy-2-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]acetic acid IUPAC Name: 2-[(2R,4R)-6-cyano-7-fluoro-4-hydroxy-2-methyl-2,3-dihydrochromen-4-yl]acetic acid Traditional Name: 2-[(2R,4R)-6-cyano-7-fluoro-4-hydroxy-2-methyl-chroman-4-yl]acetic acid Formula: C13H12FNO4 MolecularWeight: 265.237083

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2=C(O1)C=C(C(=C2)C#N)F)(CC(=O)O)O

Isomeric SMILES

C[C@@H]1C[C@](C2=C(O1)C=C(C(=C2)C#N)F)(CC(=O)O)O

InChI

InChI=1S/C13H12FNO4/c1-7-4-13(18,5-12(16)17)9-2-8(6-15)10(14)3-11(9)19-7/h2-3,7,18H,4-5H2,1H3,(H,16,17)/t7-,13-/m1/s1