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

Systemtic Name: 1-(4-cyanophenyl)-3-(2-phenylpropyl)-5-propyl-pyrazole-4-carboxylic acid Openeye Name: 1-(4-cyanophenyl)-3-(2-phenylpropyl)-5-propyl-pyrazole-4-carboxylic acid CAS Name: 1-(4-cyanophenyl)-3-(2-phenylpropyl)-5-propyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-cyanophenyl)-3-(2-phenylpropyl)-5-propylpyrazole-4-carboxylic acid Traditional Name: 1-(4-cyanophenyl)-3-(2-phenylpropyl)-5-propyl-pyrazole-4-carboxylic acid Formula: C23H23N3O2 MolecularWeight: 373.44762

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1C2=CC=C(C=C2)C#N)CC(C)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCC1=C(C(=NN1C2=CC=C(C=C2)C#N)CC(C)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H23N3O2/c1-3-7-21-22(23(27)28)20(14-16(2)18-8-5-4-6-9-18)25-26(21)19-12-10-17(15-24)11-13-19/h4-6,8-13,16H,3,7,14H2,1-2H3,(H,27,28)