ethyl 4-[5,8-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]butanoate

Systemtic Name: ethyl 4-[5,8-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]butanoate Openeye Name: ethyl 4-(5,8-dinitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)butanoate CAS Name: 4-(5,8-dinitro-1,3-dioxo-2-benzo[de]isoquinolinyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(5,8-dinitro-1,3-dioxobenzo[de]isoquinolin-2-yl)butanoate Traditional Name: 4-(1,3-diketo-5,8-dinitro-benzo[de]isoquinolin-2-yl)butyric acid ethyl ester Formula: C18H15N3O8 MolecularWeight: 401.327

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C(=O)C2=CC(=CC3=CC(=CC(=C32)C1=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCCN1C(=O)C2=CC(=CC3=CC(=CC(=C32)C1=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O8/c1-2-29-15(22)4-3-5-19-17(23)13-8-11(20(25)26)6-10-7-12(21(27)28)9-14(16(10)13)18(19)24/h6-9H,2-5H2,1H3