(4E)-4-[[3-(dimethylamino)propylamino]methylidene]-2-pyridin-2-yl-isoquinoline-1,3-dione

Systemtic Name: (4E)-4-[[3-(dimethylamino)propylamino]methylidene]-2-pyridin-2-yl-isoquinoline-1,3-dione Openeye Name: (4E)-4-[[3-(dimethylamino)propylamino]methylene]-2-(2-pyridyl)isoquinoline-1,3-dione CAS Name: (4E)-4-[[3-(dimethylamino)propylamino]methylidene]-2-(2-pyridinyl)isoquinoline-1,3-dione IUPAC Name: (4E)-4-[[3-(dimethylamino)propylamino]methylidene]-2-pyridin-2-ylisoquinoline-1,3-dione Traditional Name: (4E)-4-[[3-(dimethylamino)propylamino]methylene]-2-(2-pyridyl)isoquinoline-1,3-quinone Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=N3

Isomeric SMILES

CN(C)CCCN/C=C/1\C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=N3

InChI

InChI=1S/C20H22N4O2/c1-23(2)13-7-11-21-14-17-15-8-3-4-9-16(15)19(25)24(20(17)26)18-10-5-6-12-22-18/h3-6,8-10,12,14,21H,7,11,13H2,1-2H3/b17-14+