4-[1-(4-chlorophenyl)-5-(4-methylphenyl)pyrazol-3-yl]-4-oxidanyl-cyclohexan-1-one

Systemtic Name: 4-[1-(4-chlorophenyl)-5-(4-methylphenyl)pyrazol-3-yl]-4-oxidanyl-cyclohexan-1-one Openeye Name: 4-[1-(4-chlorophenyl)-5-(p-tolyl)pyrazol-3-yl]-4-hydroxy-cyclohexanone CAS Name: 4-[1-(4-chlorophenyl)-5-(4-methylphenyl)-3-pyrazolyl]-4-hydroxy-1-cyclohexanone IUPAC Name: 4-[1-(4-chlorophenyl)-5-(4-methylphenyl)pyrazol-3-yl]-4-hydroxycyclohexan-1-one Traditional Name: 4-[1-(4-chlorophenyl)-5-(p-tolyl)pyrazol-3-yl]-4-hydroxy-cyclohexanone Formula: C22H21ClN2O2 MolecularWeight: 380.86734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)Cl)C4(CCC(=O)CC4)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)Cl)C4(CCC(=O)CC4)O

InChI

InChI=1S/C22H21ClN2O2/c1-15-2-4-16(5-3-15)20-14-21(22(27)12-10-19(26)11-13-22)24-25(20)18-8-6-17(23)7-9-18/h2-9,14,27H,10-13H2,1H3