(2-butoxy-2-oxidanylidene-ethyl) 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate

Systemtic Name: (2-butoxy-2-oxidanylidene-ethyl) 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate Openeye Name: (2-butoxy-2-oxo-ethyl) 2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetate CAS Name: 2-(4-nitro-1,3-dioxo-2-isoindolyl)acetic acid (2-butoxy-2-oxoethyl) ester IUPAC Name: (2-butoxy-2-oxoethyl) 2-(4-nitro-1,3-dioxoisoindol-2-yl)acetate Traditional Name: 2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetic acid (2-butoxy-2-keto-ethyl) ester Formula: C16H16N2O8 MolecularWeight: 364.30684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)COC(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)COC(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O8/c1-2-3-7-25-13(20)9-26-12(19)8-17-15(21)10-5-4-6-11(18(23)24)14(10)16(17)22/h4-6H,2-3,7-9H2,1H3