1-(3-bromophenyl)-3-tert-butyl-5-chloranyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-bromophenyl)-3-tert-butyl-5-chloranyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-bromophenyl)-3-tert-butyl-5-chloro-pyrazole-4-carboxylic acid CAS Name: 1-(3-bromophenyl)-3-tert-butyl-5-chloro-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-bromophenyl)-3-tert-butyl-5-chloropyrazole-4-carboxylic acid Traditional Name: 1-(3-bromophenyl)-3-tert-butyl-5-chloro-pyrazole-4-carboxylic acid Formula: C14H14BrClN2O2 MolecularWeight: 357.63016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1C(=O)O)Cl)C2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1C(=O)O)Cl)C2=CC(=CC=C2)Br

InChI

InChI=1S/C14H14BrClN2O2/c1-14(2,3)11-10(13(19)20)12(16)18(17-11)9-6-4-5-8(15)7-9/h4-7H,1-3H3,(H,19,20)