6-azanylidene-1-(4-bromophenyl)-5-cyano-4-methyl-pyridazine-3-carboxylic acid

Systemtic Name: 6-azanylidene-1-(4-bromophenyl)-5-cyano-4-methyl-pyridazine-3-carboxylic acid Openeye Name: 1-(4-bromophenyl)-5-cyano-6-imino-4-methyl-pyridazine-3-carboxylic acid CAS Name: 1-(4-bromophenyl)-5-cyano-6-imino-4-methyl-3-pyridazinecarboxylic acid IUPAC Name: 1-(4-bromophenyl)-5-cyano-6-imino-4-methylpyridazine-3-carboxylic acid Traditional Name: 1-(4-bromophenyl)-5-cyano-6-imino-4-methyl-pyridazine-3-carboxylic acid Formula: C13H9BrN4O2 MolecularWeight: 333.14016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=N)N(N=C1C(=O)O)C2=CC=C(C=C2)Br)C#N

Isomeric SMILES

CC1=C(C(=N)N(N=C1C(=O)O)C2=CC=C(C=C2)Br)C#N

InChI

InChI=1S/C13H9BrN4O2/c1-7-10(6-15)12(16)18(17-11(7)13(19)20)9-4-2-8(14)3-5-9/h2-5,16H,1H3,(H,19,20)