5-nitro-1-(4-oxidanylbutyl)indole-2,3-dione

Systemtic Name: 5-nitro-1-(4-oxidanylbutyl)indole-2,3-dione Openeye Name: 1-(4-hydroxybutyl)-5-nitro-indoline-2,3-dione CAS Name: 1-(4-hydroxybutyl)-5-nitroindole-2,3-dione IUPAC Name: 1-(4-hydroxybutyl)-5-nitroindole-2,3-dione Traditional Name: 1-(4-hydroxybutyl)-5-nitro-isatin Formula: C12H12N2O5 MolecularWeight: 264.23408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2CCCCO

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2CCCCO

InChI

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