2-butyl-4-chloranyl-pyrazole-3-carboxylate

Systemtic Name: 2-butyl-4-chloranyl-pyrazole-3-carboxylate Openeye Name: 2-butyl-4-chloro-pyrazole-3-carboxylate CAS Name: 2-butyl-4-chloro-3-pyrazolecarboxylate IUPAC Name: 2-butyl-4-chloropyrazole-3-carboxylate Traditional Name: 2-butyl-4-chloro-pyrazole-3-carboxylate Formula: C8H10ClN2O2- MolecularWeight: 201.6302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C=N1)Cl)C(=O)[O-]

Isomeric SMILES

CCCCN1C(=C(C=N1)Cl)C(=O)[O-]

InChI

InChI=1S/C8H11ClN2O2/c1-2-3-4-11-7(8(12)13)6(9)5-10-11/h5H,2-4H2,1H3,(H,12,13)/p-1