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

Systemtic Name: 1-(4-cyanophenyl)-3-ethyl-5-propyl-pyrazole-4-carboxylic acid Openeye Name: 1-(4-cyanophenyl)-3-ethyl-5-propyl-pyrazole-4-carboxylic acid CAS Name: 1-(4-cyanophenyl)-3-ethyl-5-propyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-cyanophenyl)-3-ethyl-5-propylpyrazole-4-carboxylic acid Traditional Name: 1-(4-cyanophenyl)-3-ethyl-5-propyl-pyrazole-4-carboxylic acid Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1C2=CC=C(C=C2)C#N)CC)C(=O)O

Isomeric SMILES

CCCC1=C(C(=NN1C2=CC=C(C=C2)C#N)CC)C(=O)O

InChI

InChI=1S/C16H17N3O2/c1-3-5-14-15(16(20)21)13(4-2)18-19(14)12-8-6-11(10-17)7-9-12/h6-9H,3-5H2,1-2H3,(H,20,21)