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

Systemtic Name: ethyl 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-3-nitro-benzoate Openeye Name: ethyl 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-3-nitro-benzoate CAS Name: 4-(1,3-dioxo-2-benzo[de]isoquinolinyl)-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-3-nitrobenzoate Traditional Name: 4-(1,3-diketobenzo[de]isoquinolin-2-yl)-3-nitro-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=C3C(=CC=C4)C2=O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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