5,6-dimethoxy-3-[[1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]methyl]-2,3-dihydroisoindol-1-one

Systemtic Name: 5,6-dimethoxy-3-[[1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]methyl]-2,3-dihydroisoindol-1-one Openeye Name: 5,6-dimethoxy-3-[[1-(3-pyridylmethyl)pyrrolidin-3-yl]methyl]isoindolin-1-one CAS Name: 5,6-dimethoxy-3-[[1-(3-pyridinylmethyl)-3-pyrrolidinyl]methyl]-2,3-dihydroisoindol-1-one IUPAC Name: 5,6-dimethoxy-3-[[1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]methyl]-2,3-dihydroisoindol-1-one Traditional Name: 5,6-dimethoxy-3-[[1-(3-pyridylmethyl)pyrrolidin-3-yl]methyl]isoindolin-1-one Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(NC2=O)CC3CCN(C3)CC4=CN=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(NC2=O)CC3CCN(C3)CC4=CN=CC=C4)OC

InChI

InChI=1S/C21H25N3O3/c1-26-19-9-16-17(10-20(19)27-2)21(25)23-18(16)8-14-5-7-24(12-14)13-15-4-3-6-22-11-15/h3-4,6,9-11,14,18H,5,7-8,12-13H2,1-2H3,(H,23,25)