3,5-diethyl-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 3,5-diethyl-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 3,5-diethyl-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 3,5-diethyl-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 3,5-diethyl-1-phenylpyrazole-4-carboxylic acid Traditional Name: 3,5-diethyl-1-phenyl-pyrazole-4-carboxylic acid Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC=CC=C2)CC)C(=O)O

Isomeric SMILES

CCC1=C(C(=NN1C2=CC=CC=C2)CC)C(=O)O

InChI

InChI=1S/C14H16N2O2/c1-3-11-13(14(17)18)12(4-2)16(15-11)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3,(H,17,18)