1-(4-cyanophenyl)-5-propan-2-yl-3-propyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-cyanophenyl)-5-propan-2-yl-3-propyl-pyrazole-4-carboxylic acid Openeye Name: 1-(4-cyanophenyl)-5-isopropyl-3-propyl-pyrazole-4-carboxylic acid CAS Name: 1-(4-cyanophenyl)-5-propan-2-yl-3-propyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-cyanophenyl)-5-propan-2-yl-3-propylpyrazole-4-carboxylic acid Traditional Name: 1-(4-cyanophenyl)-5-isopropyl-3-propyl-pyrazole-4-carboxylic acid Formula: C17H19N3O2 MolecularWeight: 297.35166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1C(=O)O)C(C)C)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCC1=NN(C(=C1C(=O)O)C(C)C)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H19N3O2/c1-4-5-14-15(17(21)22)16(11(2)3)20(19-14)13-8-6-12(10-18)7-9-13/h6-9,11H,4-5H2,1-3H3,(H,21,22)