1-(4-bromanyl-3-methyl-phenyl)-6-methyl-4-oxidanylidene-pyridazine-3-carboxylic acid

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-6-methyl-4-oxidanylidene-pyridazine-3-carboxylic acid Openeye Name: 1-(4-bromo-3-methyl-phenyl)-6-methyl-4-oxo-pyridazine-3-carboxylic acid CAS Name: 1-(4-bromo-3-methylphenyl)-6-methyl-4-oxo-3-pyridazinecarboxylic acid IUPAC Name: 1-(4-bromo-3-methylphenyl)-6-methyl-4-oxopyridazine-3-carboxylic acid Traditional Name: 1-(4-bromo-3-methyl-phenyl)-4-keto-6-methyl-pyridazine-3-carboxylic acid Formula: C13H11BrN2O3 MolecularWeight: 323.14204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC(=C(C=C2)Br)C)C(=O)O

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC(=C(C=C2)Br)C)C(=O)O

InChI

InChI=1S/C13H11BrN2O3/c1-7-5-9(3-4-10(7)14)16-8(2)6-11(17)12(15-16)13(18)19/h3-6H,1-2H3,(H,18,19)