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

Systemtic Name: 1-(3-chlorophenyl)-3-cyclohexyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-chlorophenyl)-3-cyclohexyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-chlorophenyl)-3-cyclohexyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-chlorophenyl)-3-cyclohexylpyrazole-4-carboxylic acid Traditional Name: 1-(3-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=C3)Cl

Isomeric SMILES

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

InChI

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