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

Systemtic Name: 5,6-dimethoxy-2-[[1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]methyl]-3H-isoindol-1-one Openeye Name: 5,6-dimethoxy-2-[[1-(3-pyridylmethyl)pyrrolidin-3-yl]methyl]isoindolin-1-one CAS Name: 5,6-dimethoxy-2-[[1-(3-pyridinylmethyl)-3-pyrrolidinyl]methyl]-3H-isoindol-1-one IUPAC Name: 5,6-dimethoxy-2-[[1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]methyl]-3H-isoindol-1-one Traditional Name: 5,6-dimethoxy-2-[[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)CN(C2=O)CC3CCN(C3)CC4=CN=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CN(C2=O)CC3CCN(C3)CC4=CN=CC=C4)OC

InChI

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