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

Systemtic Name: ethyl 4-[5-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C21H14N2O6 MolecularWeight: 390.34566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14N2O6/c1-2-29-21(26)12-6-8-14(9-7-12)22-19(24)16-5-3-4-13-10-15(23(27)28)11-17(18(13)16)20(22)25/h3-11H,2H2,1H3