methyl 4-[5-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoate

Systemtic Name: methyl 4-[5-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoate Openeye Name: methyl 4-(5-nitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)benzoate CAS Name: 4-(5-nitro-1,3-dioxo-2-benzo[de]isoquinolinyl)benzoic acid methyl ester IUPAC Name: methyl 4-(5-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)benzoate Traditional Name: 4-(1,3-diketo-5-nitro-benzo[de]isoquinolin-2-yl)benzoic acid methyl ester Formula: C20H12N2O6 MolecularWeight: 376.31908

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-]

InChI

InChI=1S/C20H12N2O6/c1-28-20(25)11-5-7-13(8-6-11)21-18(23)15-4-2-3-12-9-14(22(26)27)10-16(17(12)15)19(21)24/h2-10H,1H3