1-(4-butylphenyl)-4-oxidanyl-pyrazole-3-carboxylic acid

Systemtic Name: 1-(4-butylphenyl)-4-oxidanyl-pyrazole-3-carboxylic acid Openeye Name: 1-(4-butylphenyl)-4-hydroxy-pyrazole-3-carboxylic acid CAS Name: 1-(4-butylphenyl)-4-hydroxy-3-pyrazolecarboxylic acid IUPAC Name: 1-(4-butylphenyl)-4-hydroxypyrazole-3-carboxylic acid Traditional Name: 1-(4-butylphenyl)-4-hydroxy-pyrazole-3-carboxylic acid Formula: C14H16N2O3 MolecularWeight: 260.28844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C=C(C(=N2)C(=O)O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C=C(C(=N2)C(=O)O)O

InChI

InChI=1S/C14H16N2O3/c1-2-3-4-10-5-7-11(8-6-10)16-9-12(17)13(15-16)14(18)19/h5-9,17H,2-4H2,1H3,(H,18,19)