1-(4-cyanophenyl)-5-ethyl-3-hex-3-enyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-cyanophenyl)-5-ethyl-3-hex-3-enyl-pyrazole-4-carboxylic acid Openeye Name: 1-(4-cyanophenyl)-5-ethyl-3-hex-3-enyl-pyrazole-4-carboxylic acid CAS Name: 1-(4-cyanophenyl)-5-ethyl-3-hex-3-enyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-cyanophenyl)-5-ethyl-3-hex-3-enylpyrazole-4-carboxylic acid Traditional Name: 1-(4-cyanophenyl)-5-ethyl-3-hex-3-enyl-pyrazole-4-carboxylic acid Formula: C19H21N3O2 MolecularWeight: 323.38894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O2/c1-3-5-6-7-8-16-18(19(23)24)17(4-2)22(21-16)15-11-9-14(13-20)10-12-15/h5-6,9-12H,3-4,7-8H2,1-2H3,(H,23,24)