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

Systemtic Name: 2-(4-ethoxy-2-nitro-phenyl)-7-methoxy-4H-isoquinoline-1,3-dione Openeye Name: 2-(4-ethoxy-2-nitro-phenyl)-7-methoxy-4H-isoquinoline-1,3-dione CAS Name: 2-(4-ethoxy-2-nitrophenyl)-7-methoxy-4H-isoquinoline-1,3-dione IUPAC Name: 2-(4-ethoxy-2-nitrophenyl)-7-methoxy-4H-isoquinoline-1,3-dione Traditional Name: 2-(4-ethoxy-2-nitro-phenyl)-7-methoxy-4H-isoquinoline-1,3-quinone Formula: C18H16N2O6 MolecularWeight: 356.32944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)N2C(=O)CC3=C(C2=O)C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)N2C(=O)CC3=C(C2=O)C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O6/c1-3-26-13-6-7-15(16(10-13)20(23)24)19-17(21)8-11-4-5-12(25-2)9-14(11)18(19)22/h4-7,9-10H,3,8H2,1-2H3