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

Systemtic Name: 2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethyl ethanoate Openeye Name: 2-(5-nitro-1,3-dioxo-isoindolin-2-yl)ethyl acetate CAS Name: acetic acid 2-(5-nitro-1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(5-nitro-1,3-dioxoisoindol-2-yl)ethyl acetate Traditional Name: acetic acid 2-(1,3-diketo-5-nitro-isoindolin-2-yl)ethyl ester Formula: C12H10N2O6 MolecularWeight: 278.2176

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O6/c1-7(15)20-5-4-13-11(16)9-3-2-8(14(18)19)6-10(9)12(13)17/h2-3,6H,4-5H2,1H3