ethyl 2-[[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[(5-nitro-1,3-dioxo-isoindolin-2-yl)methyl]-3-oxo-butanoate CAS Name: 2-[(5-nitro-1,3-dioxo-2-isoindolyl)methyl]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[(5-nitro-1,3-dioxoisoindol-2-yl)methyl]-3-oxobutanoate Traditional Name: 2-[(1,3-diketo-5-nitro-isoindolin-2-yl)methyl]-3-keto-butyric acid ethyl ester Formula: C15H14N2O7 MolecularWeight: 334.28086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCOC(=O)C(CN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C15H14N2O7/c1-3-24-15(21)12(8(2)18)7-16-13(19)10-5-4-9(17(22)23)6-11(10)14(16)20/h4-6,12H,3,7H2,1-2H3