2-(3-chloranyl-5-methyl-phenyl)pyrazole-3,4-dicarboxylic acid

Systemtic Name: 2-(3-chloranyl-5-methyl-phenyl)pyrazole-3,4-dicarboxylic acid Openeye Name: 2-(3-chloro-5-methyl-phenyl)pyrazole-3,4-dicarboxylic acid CAS Name: 2-(3-chloro-5-methylphenyl)pyrazole-3,4-dicarboxylic acid IUPAC Name: 2-(3-chloro-5-methylphenyl)pyrazole-3,4-dicarboxylic acid Traditional Name: 2-(3-chloro-5-methyl-phenyl)pyrazole-3,4-dicarboxylic acid Formula: C12H9ClN2O4 MolecularWeight: 280.66386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)Cl)N2C(=C(C=N2)C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1)Cl)N2C(=C(C=N2)C(=O)O)C(=O)O

InChI

InChI=1S/C12H9ClN2O4/c1-6-2-7(13)4-8(3-6)15-10(12(18)19)9(5-14-15)11(16)17/h2-5H,1H3,(H,16,17)(H,18,19)