1-butyl-5-chloranyl-3-methyl-pyrazole-4-carboxylate

Systemtic Name: 1-butyl-5-chloranyl-3-methyl-pyrazole-4-carboxylate Openeye Name: 1-butyl-5-chloro-3-methyl-pyrazole-4-carboxylate CAS Name: 1-butyl-5-chloro-3-methyl-4-pyrazolecarboxylate IUPAC Name: 1-butyl-5-chloro-3-methylpyrazole-4-carboxylate Traditional Name: 1-butyl-5-chloro-3-methyl-pyrazole-4-carboxylate Formula: C9H12ClN2O2- MolecularWeight: 215.65678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13ClN2O2/c1-3-4-5-12-8(10)7(9(13)14)6(2)11-12/h3-5H2,1-2H3,(H,13,14)/p-1