5-(2-chloranyl-3,5-dinitro-phenyl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(2-chloranyl-3,5-dinitro-phenyl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-(2-chloro-3,5-dinitro-phenyl)-5-oxo-pentanoic acid CAS Name: 5-(2-chloro-3,5-dinitrophenyl)-5-oxopentanoic acid IUPAC Name: 5-(2-chloro-3,5-dinitrophenyl)-5-oxopentanoic acid Traditional Name: 5-(2-chloro-3,5-dinitro-phenyl)-5-keto-valeric acid Formula: C11H9ClN2O7 MolecularWeight: 316.65136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9ClN2O7/c12-11-7(9(15)2-1-3-10(16)17)4-6(13(18)19)5-8(11)14(20)21/h4-5H,1-3H2,(H,16,17)