2-(3,4-dimethoxyphenyl)-4-[(pyridin-2-ylamino)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(3,4-dimethoxyphenyl)-4-[(pyridin-2-ylamino)methylidene]isoquinoline-1,3-dione Openeye Name: 2-(3,4-dimethoxyphenyl)-4-[(2-pyridylamino)methylene]isoquinoline-1,3-dione CAS Name: 2-(3,4-dimethoxyphenyl)-4-[(2-pyridinylamino)methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(3,4-dimethoxyphenyl)-4-[(pyridin-2-ylamino)methylidene]isoquinoline-1,3-dione Traditional Name: 2-(3,4-dimethoxyphenyl)-4-[(2-pyridylamino)methylene]isoquinoline-1,3-quinone Formula: C23H19N3O4 MolecularWeight: 401.41466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC=CC=N4)C2=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC=CC=N4)C2=O)OC

InChI

InChI=1S/C23H19N3O4/c1-29-19-11-10-15(13-20(19)30-2)26-22(27)17-8-4-3-7-16(17)18(23(26)28)14-25-21-9-5-6-12-24-21/h3-14H,1-2H3,(H,24,25)