(4E)-2-(3,4-dimethoxyphenyl)-4-[(1H-indazol-5-ylamino)methylidene]isoquinoline-1,3-dione

Systemtic Name: (4E)-2-(3,4-dimethoxyphenyl)-4-[(1H-indazol-5-ylamino)methylidene]isoquinoline-1,3-dione Openeye Name: (4E)-2-(3,4-dimethoxyphenyl)-4-[(1H-indazol-5-ylamino)methylene]isoquinoline-1,3-dione CAS Name: (4E)-2-(3,4-dimethoxyphenyl)-4-[(1H-indazol-5-ylamino)methylidene]isoquinoline-1,3-dione IUPAC Name: (4E)-2-(3,4-dimethoxyphenyl)-4-[(1H-indazol-5-ylamino)methylidene]isoquinoline-1,3-dione Traditional Name: (4E)-2-(3,4-dimethoxyphenyl)-4-[(1H-indazol-5-ylamino)methylene]isoquinoline-1,3-quinone Formula: C25H20N4O4 MolecularWeight: 440.4507

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC5=C(C=C4)NN=C5)C2=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3/C(=C\NC4=CC5=C(C=C4)NN=C5)/C2=O)OC

InChI

InChI=1S/C25H20N4O4/c1-32-22-10-8-17(12-23(22)33-2)29-24(30)19-6-4-3-5-18(19)20(25(29)31)14-26-16-7-9-21-15(11-16)13-27-28-21/h3-14,26H,1-2H3,(H,27,28)/b20-14+