3-tert-butyl-1-(3-chloranyl-4-methyl-phenyl)pyrazole-4-carboxylic acid

Systemtic Name: 3-tert-butyl-1-(3-chloranyl-4-methyl-phenyl)pyrazole-4-carboxylic acid Openeye Name: 3-tert-butyl-1-(3-chloro-4-methyl-phenyl)pyrazole-4-carboxylic acid CAS Name: 3-tert-butyl-1-(3-chloro-4-methylphenyl)-4-pyrazolecarboxylic acid IUPAC Name: 3-tert-butyl-1-(3-chloro-4-methylphenyl)pyrazole-4-carboxylic acid Traditional Name: 3-tert-butyl-1-(3-chloro-4-methyl-phenyl)pyrazole-4-carboxylic acid Formula: C15H17ClN2O2 MolecularWeight: 292.76068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17ClN2O2/c1-9-5-6-10(7-12(9)16)18-8-11(14(19)20)13(17-18)15(2,3)4/h5-8H,1-4H3,(H,19,20)