4-chloranyl-1-propan-2-yl-pyrazole-3-carboxylic acid

Systemtic Name: 4-chloranyl-1-propan-2-yl-pyrazole-3-carboxylic acid Openeye Name: 4-chloro-1-isopropyl-pyrazole-3-carboxylic acid CAS Name: 4-chloro-1-propan-2-yl-3-pyrazolecarboxylic acid IUPAC Name: 4-chloro-1-propan-2-ylpyrazole-3-carboxylic acid Traditional Name: 4-chloro-1-isopropyl-pyrazole-3-carboxylic acid Formula: C7H9ClN2O2 MolecularWeight: 188.61156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C(=N1)C(=O)O)Cl

Isomeric SMILES

CC(C)N1C=C(C(=N1)C(=O)O)Cl

InChI

InChI=1S/C7H9ClN2O2/c1-4(2)10-3-5(8)6(9-10)7(11)12/h3-4H,1-2H3,(H,11,12)