2-(4-ethoxy-2-nitro-phenyl)-7-methoxy-4-(phenylazanylmethylidene)isoquinoline-1,3-dione

Systemtic Name: 2-(4-ethoxy-2-nitro-phenyl)-7-methoxy-4-(phenylazanylmethylidene)isoquinoline-1,3-dione Openeye Name: 4-(anilinomethylene)-2-(4-ethoxy-2-nitro-phenyl)-7-methoxy-isoquinoline-1,3-dione CAS Name: 4-(anilinomethylidene)-2-(4-ethoxy-2-nitrophenyl)-7-methoxyisoquinoline-1,3-dione IUPAC Name: 4-(anilinomethylidene)-2-(4-ethoxy-2-nitrophenyl)-7-methoxyisoquinoline-1,3-dione Traditional Name: 4-(anilinomethylene)-2-(4-ethoxy-2-nitro-phenyl)-7-methoxy-isoquinoline-1,3-quinone Formula: C25H21N3O6 MolecularWeight: 459.45074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)N2C(=O)C3=C(C=CC(=C3)OC)C(=CNC4=CC=CC=C4)C2=O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)N2C(=O)C3=C(C=CC(=C3)OC)C(=CNC4=CC=CC=C4)C2=O)[N+](=O)[O-]

InChI

InChI=1S/C25H21N3O6/c1-3-34-18-10-12-22(23(14-18)28(31)32)27-24(29)20-13-17(33-2)9-11-19(20)21(25(27)30)15-26-16-7-5-4-6-8-16/h4-15,26H,3H2,1-2H3