4-(2-chloranyl-5-nitro-phenyl)-6-methyl-1,4-dihydropyridazine-3,5-dicarboxylic acid

Systemtic Name: 4-(2-chloranyl-5-nitro-phenyl)-6-methyl-1,4-dihydropyridazine-3,5-dicarboxylic acid Openeye Name: 4-(2-chloro-5-nitro-phenyl)-6-methyl-1,4-dihydropyridazine-3,5-dicarboxylic acid CAS Name: 4-(2-chloro-5-nitrophenyl)-6-methyl-1,4-dihydropyridazine-3,5-dicarboxylic acid IUPAC Name: 4-(2-chloro-5-nitrophenyl)-6-methyl-1,4-dihydropyridazine-3,5-dicarboxylic acid Traditional Name: 4-(2-chloro-5-nitro-phenyl)-6-methyl-1,4-dihydropyridazine-3,5-dicarboxylic acid Formula: C13H10ClN3O6 MolecularWeight: 339.688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=NN1)C(=O)O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)O

Isomeric SMILES

CC1=C(C(C(=NN1)C(=O)O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)O

InChI

InChI=1S/C13H10ClN3O6/c1-5-9(12(18)19)10(11(13(20)21)16-15-5)7-4-6(17(22)23)2-3-8(7)14/h2-4,10,15H,1H3,(H,18,19)(H,20,21)