N-[2-(dimethylamino)-5aH-cyclohepta[b][1]benzofuran-9-yl]isoquinoline-3-carboxamide

Systemtic Name: N-[2-(dimethylamino)-5aH-cyclohepta[b][1]benzofuran-9-yl]isoquinoline-3-carboxamide Openeye Name: N-[2-(dimethylamino)-5aH-cyclohepta[b]benzofuran-9-yl]isoquinoline-3-carboxamide CAS Name: N-[2-(dimethylamino)-5aH-cyclohepta[b]benzofuran-9-yl]-3-isoquinolinecarboxamide IUPAC Name: N-[2-(dimethylamino)-5aH-cyclohepta[b][1]benzofuran-9-yl]isoquinoline-3-carboxamide Traditional Name: N-[2-(dimethylamino)-5aH-cyclohepta[b]benzofuran-9-yl]isoquinoline-3-carboxamide Formula: C25H21N3O2 MolecularWeight: 395.45314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)OC3C2=CC(=CC=C3)NC(=O)C4=CC5=CC=CC=C5C=N4

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)OC3C2=CC(=CC=C3)NC(=O)C4=CC5=CC=CC=C5C=N4

InChI

InChI=1S/C25H21N3O2/c1-28(2)19-10-11-24-21(14-19)20-13-18(8-5-9-23(20)30-24)27-25(29)22-12-16-6-3-4-7-17(16)15-26-22/h3-15,23H,1-2H3,(H,27,29)