5-bromanyl-1-(3-cyanophenyl)-6-ethyl-4-oxidanylidene-pyridazine-3-carboxylic acid

Systemtic Name: 5-bromanyl-1-(3-cyanophenyl)-6-ethyl-4-oxidanylidene-pyridazine-3-carboxylic acid Openeye Name: 5-bromo-1-(3-cyanophenyl)-6-ethyl-4-oxo-pyridazine-3-carboxylic acid CAS Name: 5-bromo-1-(3-cyanophenyl)-6-ethyl-4-oxo-3-pyridazinecarboxylic acid IUPAC Name: 5-bromo-1-(3-cyanophenyl)-6-ethyl-4-oxopyridazine-3-carboxylic acid Traditional Name: 5-bromo-1-(3-cyanophenyl)-6-ethyl-4-keto-pyridazine-3-carboxylic acid Formula: C14H10BrN3O3 MolecularWeight: 348.1515

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C(=NN1C2=CC=CC(=C2)C#N)C(=O)O)Br

Isomeric SMILES

CCC1=C(C(=O)C(=NN1C2=CC=CC(=C2)C#N)C(=O)O)Br

InChI

InChI=1S/C14H10BrN3O3/c1-2-10-11(15)13(19)12(14(20)21)17-18(10)9-5-3-4-8(6-9)7-16/h3-6H,2H2,1H3,(H,20,21)