4-(2-chloranyl-5-nitro-phenyl)-1,2,6-trimethyl-4H-pyridine-3,5-dicarboxylic acid

Systemtic Name: 4-(2-chloranyl-5-nitro-phenyl)-1,2,6-trimethyl-4H-pyridine-3,5-dicarboxylic acid Openeye Name: 4-(2-chloro-5-nitro-phenyl)-1,2,6-trimethyl-4H-pyridine-3,5-dicarboxylic acid CAS Name: 4-(2-chloro-5-nitrophenyl)-1,2,6-trimethyl-4H-pyridine-3,5-dicarboxylic acid IUPAC Name: 4-(2-chloro-5-nitrophenyl)-1,2,6-trimethyl-4H-pyridine-3,5-dicarboxylic acid Traditional Name: 4-(2-chloro-5-nitro-phenyl)-1,2,6-trimethyl-4H-pyridine-3,5-dicarboxylic acid Formula: C16H15ClN2O6 MolecularWeight: 366.7531

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1C)C)C(=O)O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1C)C)C(=O)O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)O

InChI

InChI=1S/C16H15ClN2O6/c1-7-12(15(20)21)14(13(16(22)23)8(2)18(7)3)10-6-9(19(24)25)4-5-11(10)17/h4-6,14H,1-3H3,(H,20,21)(H,22,23)