N-[5,8-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-3-methyl-butanamide

Systemtic Name: N-[5,8-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-3-methyl-butanamide Openeye Name: N-(5,8-dinitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)-3-methyl-butanamide CAS Name: N-(5,8-dinitro-1,3-dioxo-2-benzo[de]isoquinolinyl)-3-methylbutanamide IUPAC Name: N-(5,8-dinitro-1,3-dioxobenzo[de]isoquinolin-2-yl)-3-methylbutanamide Traditional Name: N-(1,3-diketo-5,8-dinitro-benzo[de]isoquinolin-2-yl)-3-methyl-butyramide Formula: C17H14N4O7 MolecularWeight: 386.31566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NN1C(=O)C2=CC(=CC3=CC(=CC(=C32)C1=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(=O)NN1C(=O)C2=CC(=CC3=CC(=CC(=C32)C1=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O7/c1-8(2)3-14(22)18-19-16(23)12-6-10(20(25)26)4-9-5-11(21(27)28)7-13(15(9)12)17(19)24/h4-8H,3H2,1-2H3,(H,18,22)