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

Systemtic Name: 5,6-dimethyl-2-[3-[methyl(2-pyridin-3-ylethyl)amino]propyl]-3H-isoindol-1-one Openeye Name: 5,6-dimethyl-2-[3-[methyl-[2-(3-pyridyl)ethyl]amino]propyl]isoindolin-1-one CAS Name: 5,6-dimethyl-2-[3-[methyl-[2-(3-pyridinyl)ethyl]amino]propyl]-3H-isoindol-1-one IUPAC Name: 5,6-dimethyl-2-[3-[methyl(2-pyridin-3-ylethyl)amino]propyl]-3H-isoindol-1-one Traditional Name: 5,6-dimethyl-2-[3-[methyl-[2-(3-pyridyl)ethyl]amino]propyl]isoindolin-1-one Formula: C21H27N3O MolecularWeight: 337.45858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CN(C2=O)CCCN(C)CCC3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CN(C2=O)CCCN(C)CCC3=CN=CC=C3)C

InChI

InChI=1S/C21H27N3O/c1-16-12-19-15-24(21(25)20(19)13-17(16)2)10-5-9-23(3)11-7-18-6-4-8-22-14-18/h4,6,8,12-14H,5,7,9-11,15H2,1-3H3