5,6-dimethyl-2-[[1-(3-pyridin-4-ylpropyl)pyrrolidin-3-yl]methyl]-3H-isoindol-1-one

Systemtic Name: 5,6-dimethyl-2-[[1-(3-pyridin-4-ylpropyl)pyrrolidin-3-yl]methyl]-3H-isoindol-1-one Openeye Name: 5,6-dimethyl-2-[[1-[3-(4-pyridyl)propyl]pyrrolidin-3-yl]methyl]isoindolin-1-one CAS Name: 5,6-dimethyl-2-[[1-(3-pyridin-4-ylpropyl)-3-pyrrolidinyl]methyl]-3H-isoindol-1-one IUPAC Name: 5,6-dimethyl-2-[[1-(3-pyridin-4-ylpropyl)pyrrolidin-3-yl]methyl]-3H-isoindol-1-one Traditional Name: 5,6-dimethyl-2-[[1-[3-(4-pyridyl)propyl]pyrrolidin-3-yl]methyl]isoindolin-1-one Formula: C23H29N3O MolecularWeight: 363.49586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CN(C2=O)CC3CCN(C3)CCCC4=CC=NC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CN(C2=O)CC3CCN(C3)CCCC4=CC=NC=C4)C

InChI

InChI=1S/C23H29N3O/c1-17-12-21-16-26(23(27)22(21)13-18(17)2)15-20-7-11-25(14-20)10-3-4-19-5-8-24-9-6-19/h5-6,8-9,12-13,20H,3-4,7,10-11,14-16H2,1-2H3