1-(3-chlorophenyl)-3-hex-3-enyl-5-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-chlorophenyl)-3-hex-3-enyl-5-methyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-chlorophenyl)-3-hex-3-enyl-5-methyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-chlorophenyl)-3-hex-3-enyl-5-methyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-chlorophenyl)-3-hex-3-enyl-5-methylpyrazole-4-carboxylic acid Traditional Name: 1-(3-chlorophenyl)-3-hex-3-enyl-5-methyl-pyrazole-4-carboxylic acid Formula: C17H19ClN2O2 MolecularWeight: 318.79796

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCCC1=NN(C(=C1C(=O)O)C)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCC=CCCC1=NN(C(=C1C(=O)O)C)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H19ClN2O2/c1-3-4-5-6-10-15-16(17(21)22)12(2)20(19-15)14-9-7-8-13(18)11-14/h4-5,7-9,11H,3,6,10H2,1-2H3,(H,21,22)