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

Systemtic Name: 2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3,5-dinitrobenzoate Openeye Name: 2-(5-nitro-1,3-dioxo-isoindolin-2-yl)ethyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid 2-(5-nitro-1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(5-nitro-1,3-dioxoisoindol-2-yl)ethyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid 2-(1,3-diketo-5-nitro-isoindolin-2-yl)ethyl ester Formula: C17H10N4O10 MolecularWeight: 430.2821

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CCOC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CCOC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H10N4O10/c22-15-13-2-1-10(19(25)26)8-14(13)16(23)18(15)3-4-31-17(24)9-5-11(20(27)28)7-12(6-9)21(29)30/h1-2,5-8H,3-4H2