1-(2-chlorophenyl)-3-cyclohexyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(2-chlorophenyl)-3-cyclohexyl-pyrazole-4-carboxylic acid Openeye Name: 1-(2-chlorophenyl)-3-cyclohexyl-pyrazole-4-carboxylic acid CAS Name: 1-(2-chlorophenyl)-3-cyclohexyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(2-chlorophenyl)-3-cyclohexylpyrazole-4-carboxylic acid Traditional Name: 1-(2-chlorophenyl)-3-cyclohexyl-pyrazole-4-carboxylic acid Formula: C16H17ClN2O2 MolecularWeight: 304.77138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN(C=C2C(=O)O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CCC(CC1)C2=NN(C=C2C(=O)O)C3=CC=CC=C3Cl

InChI

InChI=1S/C16H17ClN2O2/c17-13-8-4-5-9-14(13)19-10-12(16(20)21)15(18-19)11-6-2-1-3-7-11/h4-5,8-11H,1-3,6-7H2,(H,20,21)