3-[5-(3-chlorophenyl)-2-cyclohexyl-pyrazol-3-yl]-2-(3-methylphenyl)propanoic acid

Systemtic Name: 3-[5-(3-chlorophenyl)-2-cyclohexyl-pyrazol-3-yl]-2-(3-methylphenyl)propanoic acid Openeye Name: 3-[5-(3-chlorophenyl)-2-cyclohexyl-pyrazol-3-yl]-2-(m-tolyl)propanoic acid CAS Name: 3-[5-(3-chlorophenyl)-2-cyclohexyl-3-pyrazolyl]-2-(3-methylphenyl)propanoic acid IUPAC Name: 3-[5-(3-chlorophenyl)-2-cyclohexylpyrazol-3-yl]-2-(3-methylphenyl)propanoic acid Traditional Name: 3-[5-(3-chlorophenyl)-2-cyclohexyl-pyrazol-3-yl]-2-(m-tolyl)propionic acid Formula: C25H27ClN2O2 MolecularWeight: 422.94708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CC2=CC(=NN2C3CCCCC3)C4=CC(=CC=C4)Cl)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)C(CC2=CC(=NN2C3CCCCC3)C4=CC(=CC=C4)Cl)C(=O)O

InChI

InChI=1S/C25H27ClN2O2/c1-17-7-5-8-18(13-17)23(25(29)30)15-22-16-24(19-9-6-10-20(26)14-19)27-28(22)21-11-3-2-4-12-21/h5-10,13-14,16,21,23H,2-4,11-12,15H2,1H3,(H,29,30)