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

Systemtic Name: 1-(4-carboxyphenyl)-5-cyano-4-methyl-6-oxidanylidene-pyridazine-3-carboxylic acid Openeye Name: 1-(4-carboxyphenyl)-5-cyano-4-methyl-6-oxo-pyridazine-3-carboxylic acid CAS Name: 1-(4-carboxyphenyl)-5-cyano-4-methyl-6-oxo-3-pyridazinecarboxylic acid IUPAC Name: 1-(4-carboxyphenyl)-5-cyano-4-methyl-6-oxopyridazine-3-carboxylic acid Traditional Name: 1-(4-carboxyphenyl)-5-cyano-6-keto-4-methyl-pyridazine-3-carboxylic acid Formula: C14H9N3O5 MolecularWeight: 299.23836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9N3O5/c1-7-10(6-15)12(18)17(16-11(7)14(21)22)9-4-2-8(3-5-9)13(19)20/h2-5H,1H3,(H,19,20)(H,21,22)