N-[4-(3-bromanyl-4,5-dimethoxy-phenyl)-3-cyano-7-(dimethylamino)-4H-chromen-2-yl]-2-chloranyl-ethanamide

Systemtic Name: N-[4-(3-bromanyl-4,5-dimethoxy-phenyl)-3-cyano-7-(dimethylamino)-4H-chromen-2-yl]-2-chloranyl-ethanamide Openeye Name: N-[4-(3-bromo-4,5-dimethoxy-phenyl)-3-cyano-7-(dimethylamino)-4H-chromen-2-yl]-2-chloro-acetamide CAS Name: N-[4-(3-bromo-4,5-dimethoxyphenyl)-3-cyano-7-(dimethylamino)-4H-1-benzopyran-2-yl]-2-chloroacetamide IUPAC Name: N-[4-(3-bromo-4,5-dimethoxyphenyl)-3-cyano-7-(dimethylamino)-4H-chromen-2-yl]-2-chloroacetamide Traditional Name: N-[4-(3-bromo-4,5-dimethoxy-phenyl)-3-cyano-7-(dimethylamino)-4H-chromen-2-yl]-2-chloro-acetamide Formula: C22H21BrClN3O4 MolecularWeight: 506.77684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)C(C(=C(O2)NC(=O)CCl)C#N)C3=CC(=C(C(=C3)Br)OC)OC

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)C(C(=C(O2)NC(=O)CCl)C#N)C3=CC(=C(C(=C3)Br)OC)OC

InChI

InChI=1S/C22H21BrClN3O4/c1-27(2)13-5-6-14-17(9-13)31-22(26-19(28)10-24)15(11-25)20(14)12-7-16(23)21(30-4)18(8-12)29-3/h5-9,20H,10H2,1-4H3,(H,26,28)