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

Systemtic Name: 5,6-dimethyl-2-[3-[methyl(2-pyridin-2-ylethyl)amino]propyl]-3H-isoindol-1-one Openeye Name: 5,6-dimethyl-2-[3-[methyl-[2-(2-pyridyl)ethyl]amino]propyl]isoindolin-1-one CAS Name: 5,6-dimethyl-2-[3-[methyl-[2-(2-pyridinyl)ethyl]amino]propyl]-3H-isoindol-1-one IUPAC Name: 5,6-dimethyl-2-[3-[methyl(2-pyridin-2-ylethyl)amino]propyl]-3H-isoindol-1-one Traditional Name: 5,6-dimethyl-2-[3-[methyl-[2-(2-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=CC=CC=N3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CN(C2=O)CCCN(C)CCC3=CC=CC=N3)C

InChI

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