6,7-dimethoxy-N-[2,2,2-tris(chloranyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: 6,7-dimethoxy-N-[2,2,2-tris(chloranyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 6,7-dimethoxy-N-(2,2,2-trichloroacetyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 6,7-dimethoxy-N-(2,2,2-trichloro-1-oxoethyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 6,7-dimethoxy-N-(2,2,2-trichloroacetyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 6,7-dimethoxy-N-(2,2,2-trichloroacetyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C14H15Cl3N2O4 MolecularWeight: 381.6389

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)NC(=O)C(Cl)(Cl)Cl)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)NC(=O)C(Cl)(Cl)Cl)OC

InChI

InChI=1S/C14H15Cl3N2O4/c1-22-10-5-8-3-4-19(7-9(8)6-11(10)23-2)13(21)18-12(20)14(15,16)17/h5-6H,3-4,7H2,1-2H3,(H,18,20,21)