6,7-dimethoxy-N-[2-(pyridin-4-ylmethylcarbamoyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: 6,7-dimethoxy-N-[2-(pyridin-4-ylmethylcarbamoyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 6,7-dimethoxy-N-[2-(4-pyridylmethylcarbamoyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 6,7-dimethoxy-N-[2-[oxo-(pyridin-4-ylmethylamino)methyl]phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 6,7-dimethoxy-N-[2-(pyridin-4-ylmethylcarbamoyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 6,7-dimethoxy-N-[2-(4-pyridylmethylcarbamoyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C25H26N4O4 MolecularWeight: 446.49834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)NC3=CC=CC=C3C(=O)NCC4=CC=NC=C4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)NC3=CC=CC=C3C(=O)NCC4=CC=NC=C4)OC

InChI

InChI=1S/C25H26N4O4/c1-32-22-13-18-9-12-29(16-19(18)14-23(22)33-2)25(31)28-21-6-4-3-5-20(21)24(30)27-15-17-7-10-26-11-8-17/h3-8,10-11,13-14H,9,12,15-16H2,1-2H3,(H,27,30)(H,28,31)