2-chloranyl-5-[5,8-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoate

Systemtic Name: 2-chloranyl-5-[5,8-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoate Openeye Name: 2-chloro-5-(5,8-dinitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)benzoate CAS Name: 2-chloro-5-(5,8-dinitro-1,3-dioxo-2-benzo[de]isoquinolinyl)benzoate IUPAC Name: 2-chloro-5-(5,8-dinitro-1,3-dioxobenzo[de]isoquinolin-2-yl)benzoate Traditional Name: 2-chloro-5-(1,3-diketo-5,8-dinitro-benzo[de]isoquinolin-2-yl)benzoate Formula: C19H7ClN3O8- MolecularWeight: 440.72718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-])C(=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-])C(=O)[O-])Cl

InChI

InChI=1S/C19H8ClN3O8/c20-15-2-1-9(5-12(15)19(26)27)21-17(24)13-6-10(22(28)29)3-8-4-11(23(30)31)7-14(16(8)13)18(21)25/h1-7H,(H,26,27)/p-1