5-azanyl-4-chloranyl-2-(2-methylpropyl)pyrazole-3-carboxylic acid

Systemtic Name: 5-azanyl-4-chloranyl-2-(2-methylpropyl)pyrazole-3-carboxylic acid Openeye Name: 5-amino-4-chloro-2-isobutyl-pyrazole-3-carboxylic acid CAS Name: 5-amino-4-chloro-2-(2-methylpropyl)-3-pyrazolecarboxylic acid IUPAC Name: 5-amino-4-chloro-2-(2-methylpropyl)pyrazole-3-carboxylic acid Traditional Name: 5-amino-4-chloro-2-isobutyl-pyrazole-3-carboxylic acid Formula: C8H12ClN3O2 MolecularWeight: 217.65278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=N1)N)Cl)C(=O)O

Isomeric SMILES

CC(C)CN1C(=C(C(=N1)N)Cl)C(=O)O

InChI

InChI=1S/C8H12ClN3O2/c1-4(2)3-12-6(8(13)14)5(9)7(10)11-12/h4H,3H2,1-2H3,(H2,10,11)(H,13,14)