2-[2-(3,4-dimethoxyphenyl)ethyl]-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-7-(4-pyridylmethylamino)isoindolin-1-one CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one Traditional Name: 2-homoveratryl-7-(4-pyridylmethylamino)isoindolin-1-one Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CC3=C(C2=O)C(=CC=C3)NCC4=CC=NC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CC3=C(C2=O)C(=CC=C3)NCC4=CC=NC=C4)OC

InChI

InChI=1S/C24H25N3O3/c1-29-21-7-6-17(14-22(21)30-2)10-13-27-16-19-4-3-5-20(23(19)24(27)28)26-15-18-8-11-25-12-9-18/h3-9,11-12,14,26H,10,13,15-16H2,1-2H3