5-[[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]methyl]-2,1,3-benzoxadiazole

Systemtic Name: 5-[[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]methyl]-2,1,3-benzoxadiazole Openeye Name: 5-[[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidyl]methyl]-2,1,3-benzoxadiazole CAS Name: 5-[[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidinyl]methyl]-2,1,3-benzoxadiazole IUPAC Name: 5-[[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]methyl]-2,1,3-benzoxadiazole Traditional Name: 5-[[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidino]methyl]benzofurazan Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C3CCCN(C3)CC4=CC5=NON=C5C=C4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C3CCCN(C3)CC4=CC5=NON=C5C=C4)OC

InChI

InChI=1S/C23H28N4O3/c1-28-22-11-17-7-9-27(14-18(17)12-23(22)29-2)19-4-3-8-26(15-19)13-16-5-6-20-21(10-16)25-30-24-20/h5-6,10-12,19H,3-4,7-9,13-15H2,1-2H3