5,6-dimethoxy-1-[[1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]methyl]-2,3-dihydro-1H-isoindole

Systemtic Name: 5,6-dimethoxy-1-[[1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]methyl]-2,3-dihydro-1H-isoindole Openeye Name: 5,6-dimethoxy-1-[[1-(3-pyridylmethyl)pyrrolidin-3-yl]methyl]isoindoline CAS Name: 5,6-dimethoxy-1-[[1-(3-pyridinylmethyl)-3-pyrrolidinyl]methyl]-2,3-dihydro-1H-isoindole IUPAC Name: 5,6-dimethoxy-1-[[1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]methyl]-2,3-dihydro-1H-isoindole Traditional Name: 5,6-dimethoxy-1-[[1-(3-pyridylmethyl)pyrrolidin-3-yl]methyl]isoindoline Formula: C21H27N3O2 MolecularWeight: 353.45798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCC2=C1)CC3CCN(C3)CC4=CN=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(NCC2=C1)CC3CCN(C3)CC4=CN=CC=C4)OC

InChI

InChI=1S/C21H27N3O2/c1-25-20-9-17-12-23-19(18(17)10-21(20)26-2)8-15-5-7-24(13-15)14-16-4-3-6-22-11-16/h3-4,6,9-11,15,19,23H,5,7-8,12-14H2,1-2H3