2-(2-chloranyl-4,6-dinitro-phenyl)ethanal

Systemtic Name: 2-(2-chloranyl-4,6-dinitro-phenyl)ethanal Openeye Name: 2-(2-chloro-4,6-dinitro-phenyl)acetaldehyde CAS Name: 2-(2-chloro-4,6-dinitrophenyl)acetaldehyde IUPAC Name: 2-(2-chloro-4,6-dinitrophenyl)acetaldehyde Traditional Name: 2-(2-chloro-4,6-dinitro-phenyl)acetaldehyde Formula: C8H5ClN2O5 MolecularWeight: 244.5887

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])CC=O)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])CC=O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C8H5ClN2O5/c9-7-3-5(10(13)14)4-8(11(15)16)6(7)1-2-12/h2-4H,1H2