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

Systemtic Name: (4Z)-2-(3,4-dimethoxyphenyl)-4-[(pyridin-3-ylamino)methylidene]isoquinoline-1,3-dione Openeye Name: (4Z)-2-(3,4-dimethoxyphenyl)-4-[(3-pyridylamino)methylene]isoquinoline-1,3-dione CAS Name: (4Z)-2-(3,4-dimethoxyphenyl)-4-[(3-pyridinylamino)methylidene]isoquinoline-1,3-dione IUPAC Name: (4Z)-2-(3,4-dimethoxyphenyl)-4-[(pyridin-3-ylamino)methylidene]isoquinoline-1,3-dione Traditional Name: (4Z)-2-(3,4-dimethoxyphenyl)-4-[(3-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=CN=CC=C4)C2=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3/C(=C/NC4=CN=CC=C4)/C2=O)OC

InChI

InChI=1S/C23H19N3O4/c1-29-20-10-9-16(12-21(20)30-2)26-22(27)18-8-4-3-7-17(18)19(23(26)28)14-25-15-6-5-11-24-13-15/h3-14,25H,1-2H3/b19-14-