1-(2-chlorophenyl)-N-(3-cyanophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: 1-(2-chlorophenyl)-N-(3-cyanophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 1-(2-chlorophenyl)-N-(3-cyanophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 1-(2-chlorophenyl)-N-(3-cyanophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 1-(2-chlorophenyl)-N-(3-cyanophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 1-(2-chlorophenyl)-N-(3-cyanophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C25H22ClN3O3 MolecularWeight: 447.91348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)NC3=CC=CC(=C3)C#N)C4=CC=CC=C4Cl)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)NC3=CC=CC(=C3)C#N)C4=CC=CC=C4Cl)OC

InChI

InChI=1S/C25H22ClN3O3/c1-31-22-13-17-10-11-29(25(30)28-18-7-5-6-16(12-18)15-27)24(20(17)14-23(22)32-2)19-8-3-4-9-21(19)26/h3-9,12-14,24H,10-11H2,1-2H3,(H,28,30)