2-(4-ethoxycarbonylphenyl)-5-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-4-olate

Systemtic Name: 2-(4-ethoxycarbonylphenyl)-5-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-4-olate Openeye Name: 2-(4-ethoxycarbonylphenyl)-5-nitro-1,3-dioxo-benzo[de]isoquinolin-4-olate CAS Name: 2-(4-ethoxycarbonylphenyl)-5-nitro-1,3-dioxo-4-benzo[de]isoquinolinolate IUPAC Name: 2-(4-ethoxycarbonylphenyl)-5-nitro-1,3-dioxobenzo[de]isoquinolin-4-olate Traditional Name: 2-(4-carbethoxyphenyl)-1,3-diketo-5-nitro-benzo[de]isoquinolin-4-olate Formula: C21H13N2O7- MolecularWeight: 405.33712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14N2O7/c1-2-30-21(27)11-6-8-13(9-7-11)22-19(25)14-5-3-4-12-10-15(23(28)29)18(24)17(16(12)14)20(22)26/h3-10,24H,2H2,1H3/p-1