ethyl 4-[4-[(3-nitrophenyl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]benzoate

Systemtic Name: ethyl 4-[4-[(3-nitrophenyl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]benzoate Openeye Name: ethyl 4-[4-[(3-nitrophenyl)methylene]-1,3-dioxo-2-isoquinolyl]benzoate CAS Name: 4-[4-[(3-nitrophenyl)methylidene]-1,3-dioxo-2-isoquinolinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(3-nitrophenyl)methylidene]-1,3-dioxoisoquinolin-2-yl]benzoate Traditional Name: 4-[1,3-diketo-4-(3-nitrobenzylidene)-2-isoquinolyl]benzoic acid ethyl ester Formula: C25H18N2O6 MolecularWeight: 442.42022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CC4=CC(=CC=C4)[N+](=O)[O-])C2=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CC4=CC(=CC=C4)[N+](=O)[O-])C2=O

InChI

InChI=1S/C25H18N2O6/c1-2-33-25(30)17-10-12-18(13-11-17)26-23(28)21-9-4-3-8-20(21)22(24(26)29)15-16-6-5-7-19(14-16)27(31)32/h3-15H,2H2,1H3