2-chloranyl-N-[(3R,4S)-6-ethanoyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-4-fluoranyl-benzamide

Systemtic Name: 2-chloranyl-N-[(3R,4S)-6-ethanoyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[(3R,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-chroman-4-yl]-2-chloro-4-fluoro-benzamide CAS Name: N-[(3R,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-2-chloro-4-fluorobenzamide IUPAC Name: N-[(3R,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-2-chloro-4-fluorobenzamide Traditional Name: N-[(3R,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-chroman-4-yl]-2-chloro-4-fluoro-benzamide Formula: C20H19ClFNO4 MolecularWeight: 391.820563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(C(C2NC(=O)C3=C(C=C(C=C3)F)Cl)O)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC([C@@H]([C@H]2NC(=O)C3=C(C=C(C=C3)F)Cl)O)(C)C

InChI

InChI=1S/C20H19ClFNO4/c1-10(24)11-4-7-16-14(8-11)17(18(25)20(2,3)27-16)23-19(26)13-6-5-12(22)9-15(13)21/h4-9,17-18,25H,1-3H3,(H,23,26)/t17-,18+/m0/s1