Wikipedia:  

nitrobenzene

nitrobenzene; Nitrobenzene; nitro-benzene; BENZENE-NO2; Benzene, nitro-; Nitrobenzol; benzene, nitro-; BENZENE,NITRO; Essence of Mirbane
Molecular Formula
C6 H5 N O2
Natural Isotopic Abundance Mass
123.1094
Mono-Isotopic Molecular Masses
C12N14:   123.0320284099
C13N14:   129.0521574367
C12N15:   124.0290633031
C13N15:   130.0491923299
nitrobenzene image
nitrobenzene
InCHi String:
InChI=1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H

canonical and isomeric SMILES:
C1=CC=C(C=C1)[N+](=O)[O-]


PUBCHEM iupac NAME: PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac CAS NAME: PUBCHEM iupac SYSTEMATIC NAME
nitrobenzene



PubChem Substance (SID):   111677814   8144452   10539070
PubChem Compound (CID):   7416
KEGG: Compound ID   C06813
CAS Registry IDs:   98-95-3
PDB Chemical Component   NBZ
Miscellaneous Databases and IDs:   Sigma-Aldrich 06084_FLUKA   ChEBI CHEBI:27798   EPA DSSTox 33760   ZINC ZINC00896426   BioCyc BENZENE-NO2   NMRShiftDB 10005679   NIST Chemistry WebBook 2267087588   MMCD cq_03950   MDL MFCD00007043

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.