1-(2-chloranyl-4-methyl-phenyl)pyrazole-3-carboxylate

Systemtic Name: 1-(2-chloranyl-4-methyl-phenyl)pyrazole-3-carboxylate Openeye Name: 1-(2-chloro-4-methyl-phenyl)pyrazole-3-carboxylate CAS Name: 1-(2-chloro-4-methylphenyl)-3-pyrazolecarboxylate IUPAC Name: 1-(2-chloro-4-methylphenyl)pyrazole-3-carboxylate Traditional Name: 1-(2-chloro-4-methyl-phenyl)pyrazole-3-carboxylate Formula: C11H8ClN2O2- MolecularWeight: 235.64642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CC(=N2)C(=O)[O-])Cl

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CC(=N2)C(=O)[O-])Cl

InChI

InChI=1S/C11H9ClN2O2/c1-7-2-3-10(8(12)6-7)14-5-4-9(13-14)11(15)16/h2-6H,1H3,(H,15,16)/p-1