4-nitro-2-(4-oxidanylbutyl)isoindole-1,3-dione

Systemtic Name: 4-nitro-2-(4-oxidanylbutyl)isoindole-1,3-dione Openeye Name: 2-(4-hydroxybutyl)-4-nitro-isoindoline-1,3-dione CAS Name: 2-(4-hydroxybutyl)-4-nitroisoindole-1,3-dione IUPAC Name: 2-(4-hydroxybutyl)-4-nitroisoindole-1,3-dione Traditional Name: 2-(4-hydroxybutyl)-4-nitro-isoindoline-1,3-quinone Formula: C12H12N2O5 MolecularWeight: 264.23408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O5/c15-7-2-1-6-13-11(16)8-4-3-5-9(14(18)19)10(8)12(13)17/h3-5,15H,1-2,6-7H2