1-(4-tert-butylphenyl)-3-hex-3-enyl-5-propyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-tert-butylphenyl)-3-hex-3-enyl-5-propyl-pyrazole-4-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)-3-hex-3-enyl-5-propyl-pyrazole-4-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)-3-hex-3-enyl-5-propyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)-3-hex-3-enyl-5-propylpyrazole-4-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)-3-hex-3-enyl-5-propyl-pyrazole-4-carboxylic acid Formula: C23H32N2O2 MolecularWeight: 368.51238

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)CCC=CCC)C(=O)O

Isomeric SMILES

CCCC1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)CCC=CCC)C(=O)O

InChI

InChI=1S/C23H32N2O2/c1-6-8-9-10-12-19-21(22(26)27)20(11-7-2)25(24-19)18-15-13-17(14-16-18)23(3,4)5/h8-9,13-16H,6-7,10-12H2,1-5H3,(H,26,27)