1-[2,5-bis(chloranyl)phenyl]-3-hex-3-enyl-5-propyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-[2,5-bis(chloranyl)phenyl]-3-hex-3-enyl-5-propyl-pyrazole-4-carboxylic acid Openeye Name: 1-(2,5-dichlorophenyl)-3-hex-3-enyl-5-propyl-pyrazole-4-carboxylic acid CAS Name: 1-(2,5-dichlorophenyl)-3-hex-3-enyl-5-propyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(2,5-dichlorophenyl)-3-hex-3-enyl-5-propylpyrazole-4-carboxylic acid Traditional Name: 1-(2,5-dichlorophenyl)-3-hex-3-enyl-5-propyl-pyrazole-4-carboxylic acid Formula: C19H22Cl2N2O2 MolecularWeight: 381.29618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22Cl2N2O2/c1-3-5-6-7-9-15-18(19(24)25)16(8-4-2)23(22-15)17-12-13(20)10-11-14(17)21/h5-6,10-12H,3-4,7-9H2,1-2H3,(H,24,25)