3,5-dimethyl-1-pentyl-pyrazole-4-carboxylic acid

Systemtic Name: 3,5-dimethyl-1-pentyl-pyrazole-4-carboxylic acid Openeye Name: 3,5-dimethyl-1-pentyl-pyrazole-4-carboxylic acid CAS Name: 3,5-dimethyl-1-pentyl-4-pyrazolecarboxylic acid IUPAC Name: 3,5-dimethyl-1-pentylpyrazole-4-carboxylic acid Traditional Name: 1-amyl-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C11H18N2O2 MolecularWeight: 210.27282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=C(C(=N1)C)C(=O)O)C

Isomeric SMILES

CCCCCN1C(=C(C(=N1)C)C(=O)O)C

InChI

InChI=1S/C11H18N2O2/c1-4-5-6-7-13-9(3)10(11(14)15)8(2)12-13/h4-7H2,1-3H3,(H,14,15)