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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O3/c1-14(2,3)9-4-6-10(7-5-9)16-8-11(17)12(15-16)13(18)19/h4-8,17H,1-3H3,(H,18,19)