(4E)-4-(ethoxymethylidene)-2-(4-ethoxy-2-nitro-phenyl)isoquinoline-1,3-dione

Systemtic Name: (4E)-4-(ethoxymethylidene)-2-(4-ethoxy-2-nitro-phenyl)isoquinoline-1,3-dione Openeye Name: (4E)-4-(ethoxymethylene)-2-(4-ethoxy-2-nitro-phenyl)isoquinoline-1,3-dione CAS Name: (4E)-4-(ethoxymethylidene)-2-(4-ethoxy-2-nitrophenyl)isoquinoline-1,3-dione IUPAC Name: (4E)-4-(ethoxymethylidene)-2-(4-ethoxy-2-nitrophenyl)isoquinoline-1,3-dione Traditional Name: (4E)-4-(ethoxymethylene)-2-(4-ethoxy-2-nitro-phenyl)isoquinoline-1,3-quinone Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=C(C=C(C=C3)OCC)[N+](=O)[O-]

Isomeric SMILES

CCO/C=C/1\C2=CC=CC=C2C(=O)N(C1=O)C3=C(C=C(C=C3)OCC)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O6/c1-3-27-12-16-14-7-5-6-8-15(14)19(23)21(20(16)24)17-10-9-13(28-4-2)11-18(17)22(25)26/h5-12H,3-4H2,1-2H3/b16-12+