5,6-dimethoxy-2-[3-[methyl(3-pyridin-3-ylpropyl)amino]propyl]-3H-isoindol-1-one

Systemtic Name: 5,6-dimethoxy-2-[3-[methyl(3-pyridin-3-ylpropyl)amino]propyl]-3H-isoindol-1-one Openeye Name: 5,6-dimethoxy-2-[3-[methyl-[3-(3-pyridyl)propyl]amino]propyl]isoindolin-1-one CAS Name: 5,6-dimethoxy-2-[3-[methyl-[3-(3-pyridinyl)propyl]amino]propyl]-3H-isoindol-1-one IUPAC Name: 5,6-dimethoxy-2-[3-[methyl(3-pyridin-3-ylpropyl)amino]propyl]-3H-isoindol-1-one Traditional Name: 5,6-dimethoxy-2-[3-[methyl-[3-(3-pyridyl)propyl]amino]propyl]isoindolin-1-one Formula: C22H29N3O3 MolecularWeight: 383.48396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=CN=CC=C1)CCCN2CC3=CC(=C(C=C3C2=O)OC)OC

Isomeric SMILES

CN(CCCC1=CN=CC=C1)CCCN2CC3=CC(=C(C=C3C2=O)OC)OC

InChI

InChI=1S/C22H29N3O3/c1-24(10-5-8-17-7-4-9-23-15-17)11-6-12-25-16-18-13-20(27-2)21(28-3)14-19(18)22(25)26/h4,7,9,13-15H,5-6,8,10-12,16H2,1-3H3