3-methyl-1-propyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-methyl-1-propyl-pyrazole-4-carboxylic acid Openeye Name: 3-methyl-1-propyl-pyrazole-4-carboxylic acid CAS Name: 3-methyl-1-propyl-4-pyrazolecarboxylic acid IUPAC Name: 3-methyl-1-propylpyrazole-4-carboxylic acid Traditional Name: 3-methyl-1-propyl-pyrazole-4-carboxylic acid Formula: C8H12N2O2 MolecularWeight: 168.19308

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=N1)C)C(=O)O

Isomeric SMILES

CCCN1C=C(C(=N1)C)C(=O)O

InChI

InChI=1S/C8H12N2O2/c1-3-4-10-5-7(8(11)12)6(2)9-10/h5H,3-4H2,1-2H3,(H,11,12)