1-(3-chloranyl-4-methyl-phenyl)-5-cyano-4-methyl-6-oxidanylidene-pyridazine-3-carboxylic acid

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-5-cyano-4-methyl-6-oxidanylidene-pyridazine-3-carboxylic acid Openeye Name: 1-(3-chloro-4-methyl-phenyl)-5-cyano-4-methyl-6-oxo-pyridazine-3-carboxylic acid CAS Name: 1-(3-chloro-4-methylphenyl)-5-cyano-4-methyl-6-oxo-3-pyridazinecarboxylic acid IUPAC Name: 1-(3-chloro-4-methylphenyl)-5-cyano-4-methyl-6-oxopyridazine-3-carboxylic acid Traditional Name: 1-(3-chloro-4-methyl-phenyl)-5-cyano-6-keto-4-methyl-pyridazine-3-carboxylic acid Formula: C14H10ClN3O3 MolecularWeight: 303.7005

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=C(C(=N2)C(=O)O)C)C#N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=C(C(=N2)C(=O)O)C)C#N)Cl

InChI

InChI=1S/C14H10ClN3O3/c1-7-3-4-9(5-11(7)15)18-13(19)10(6-16)8(2)12(17-18)14(20)21/h3-5H,1-2H3,(H,20,21)