5-butyl-2-(3-cyanophenyl)pyrazole-3-carboxylic acid

Systemtic Name: 5-butyl-2-(3-cyanophenyl)pyrazole-3-carboxylic acid Openeye Name: 5-butyl-2-(3-cyanophenyl)pyrazole-3-carboxylic acid CAS Name: 5-butyl-2-(3-cyanophenyl)-3-pyrazolecarboxylic acid IUPAC Name: 5-butyl-2-(3-cyanophenyl)pyrazole-3-carboxylic acid Traditional Name: 5-butyl-2-(3-cyanophenyl)pyrazole-3-carboxylic acid Formula: C15H15N3O2 MolecularWeight: 269.2985

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN(C(=C1)C(=O)O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CCCCC1=NN(C(=C1)C(=O)O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C15H15N3O2/c1-2-3-6-12-9-14(15(19)20)18(17-12)13-7-4-5-11(8-13)10-16/h4-5,7-9H,2-3,6H2,1H3,(H,19,20)