2-[3-(2-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)phenoxy]-N-(4-bromanyl-2-fluoranyl-phenyl)ethanamide

Systemtic Name: 2-[3-(2-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)phenoxy]-N-(4-bromanyl-2-fluoranyl-phenyl)ethanamide Openeye Name: 2-[3-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)phenoxy]-N-(4-bromo-2-fluoro-phenyl)acetamide CAS Name: 2-[3-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-4-yl)phenoxy]-N-(4-bromo-2-fluorophenyl)acetamide IUPAC Name: 2-[3-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)phenoxy]-N-(4-bromo-2-fluorophenyl)acetamide Traditional Name: 2-[3-(2-amino-3-cyano-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromen-4-yl)phenoxy]-N-(4-bromo-2-fluoro-phenyl)acetamide Formula: C26H23BrFN3O4 MolecularWeight: 540.380923

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=CC=C3)OCC(=O)NC4=C(C=C(C=C4)Br)F)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=CC=C3)OCC(=O)NC4=C(C=C(C=C4)Br)F)C(=O)C1)C

InChI

InChI=1S/C26H23BrFN3O4/c1-26(2)10-20(32)24-21(11-26)35-25(30)17(12-29)23(24)14-4-3-5-16(8-14)34-13-22(33)31-19-7-6-15(27)9-18(19)28/h3-9,23H,10-11,13,30H2,1-2H3,(H,31,33)