1-cyclohexyl-4-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-2-one

Systemtic Name: 1-cyclohexyl-4-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-2-one Openeye Name: 1-cyclohexyl-4-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-2-one CAS Name: 1-cyclohexyl-4-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-2-piperazinone IUPAC Name: 1-cyclohexyl-4-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-2-one Traditional Name: 1-cyclohexyl-4-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-2-one Formula: C22H30N4O3 MolecularWeight: 398.4986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=C(C=NN2)CN3CCN(C(=O)C3)C4CCCCC4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=C(C=NN2)CN3CCN(C(=O)C3)C4CCCCC4)OC

InChI

InChI=1S/C22H30N4O3/c1-28-18-8-9-19(20(12-18)29-2)22-16(13-23-24-22)14-25-10-11-26(21(27)15-25)17-6-4-3-5-7-17/h8-9,12-13,17H,3-7,10-11,14-15H2,1-2H3,(H,23,24)