6-methyl-4-(2-methylsulfonylphenyl)-1,4-dihydropyridazine-3,5-dicarboxylic acid

Systemtic Name: 6-methyl-4-(2-methylsulfonylphenyl)-1,4-dihydropyridazine-3,5-dicarboxylic acid Openeye Name: 6-methyl-4-(2-methylsulfonylphenyl)-1,4-dihydropyridazine-3,5-dicarboxylic acid CAS Name: 6-methyl-4-(2-methylsulfonylphenyl)-1,4-dihydropyridazine-3,5-dicarboxylic acid IUPAC Name: 6-methyl-4-(2-methylsulfonylphenyl)-1,4-dihydropyridazine-3,5-dicarboxylic acid Traditional Name: 4-(2-mesylphenyl)-6-methyl-1,4-dihydropyridazine-3,5-dicarboxylic acid Formula: C14H14N2O6S MolecularWeight: 338.33576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=NN1)C(=O)O)C2=CC=CC=C2S(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=C(C(C(=NN1)C(=O)O)C2=CC=CC=C2S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C14H14N2O6S/c1-7-10(13(17)18)11(12(14(19)20)16-15-7)8-5-3-4-6-9(8)23(2,21)22/h3-6,11,15H,1-2H3,(H,17,18)(H,19,20)