3-(2,4-dichlorophenyl)-5-ethyl-4-(4-pentylphenyl)pyrazole-1-carboxylic acid

Systemtic Name: 3-(2,4-dichlorophenyl)-5-ethyl-4-(4-pentylphenyl)pyrazole-1-carboxylic acid Openeye Name: 3-(2,4-dichlorophenyl)-5-ethyl-4-(4-pentylphenyl)pyrazole-1-carboxylic acid CAS Name: 3-(2,4-dichlorophenyl)-5-ethyl-4-(4-pentylphenyl)-1-pyrazolecarboxylic acid IUPAC Name: 3-(2,4-dichlorophenyl)-5-ethyl-4-(4-pentylphenyl)pyrazole-1-carboxylic acid Traditional Name: 4-(4-amylphenyl)-3-(2,4-dichlorophenyl)-5-ethyl-pyrazole-1-carboxylic acid Formula: C23H24Cl2N2O2 MolecularWeight: 431.35486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=C(N(N=C2C3=C(C=C(C=C3)Cl)Cl)C(=O)O)CC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=C(N(N=C2C3=C(C=C(C=C3)Cl)Cl)C(=O)O)CC

InChI

InChI=1S/C23H24Cl2N2O2/c1-3-5-6-7-15-8-10-16(11-9-15)21-20(4-2)27(23(28)29)26-22(21)18-13-12-17(24)14-19(18)25/h8-14H,3-7H2,1-2H3,(H,28,29)