2-(5-chloranylpyridin-2-yl)-4-[(2-dimethylaminoethylamino)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(5-chloranylpyridin-2-yl)-4-[(2-dimethylaminoethylamino)methylidene]isoquinoline-1,3-dione Openeye Name: 2-(5-chloro-2-pyridyl)-4-[(2-dimethylaminoethylamino)methylene]isoquinoline-1,3-dione CAS Name: 2-(5-chloro-2-pyridinyl)-4-[(2-dimethylaminoethylamino)methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(5-chloropyridin-2-yl)-4-[(2-dimethylaminoethylamino)methylidene]isoquinoline-1,3-dione Traditional Name: 2-(5-chloro-2-pyridyl)-4-[(2-dimethylaminoethylamino)methylene]isoquinoline-1,3-quinone Formula: C19H19ClN4O2 MolecularWeight: 370.83276

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=NC=C(C=C3)Cl

Isomeric SMILES

CN(C)CCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=NC=C(C=C3)Cl

InChI

InChI=1S/C19H19ClN4O2/c1-23(2)10-9-21-12-16-14-5-3-4-6-15(14)18(25)24(19(16)26)17-8-7-13(20)11-22-17/h3-8,11-12,21H,9-10H2,1-2H3