4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]butyl nitrate

Systemtic Name: 4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]butyl nitrate Openeye Name: 4-(5-nitro-1,3-dioxo-isoindolin-2-yl)butyl nitrate CAS Name: nitric acid 4-(5-nitro-1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(5-nitro-1,3-dioxoisoindol-2-yl)butyl nitrate Traditional Name: nitric acid 4-(1,3-diketo-5-nitro-isoindolin-2-yl)butyl ester Formula: C12H11N3O7 MolecularWeight: 309.23164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CCCCO[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CCCCO[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O7/c16-11-9-4-3-8(14(18)19)7-10(9)12(17)13(11)5-1-2-6-22-15(20)21/h3-4,7H,1-2,5-6H2