3-(2,5-dimethylphenoxy)-1-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(2,5-dimethylphenoxy)-1-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(2,5-dimethylphenoxy)-1-[4-(3-fluorobenzoyl)piperazin-1-yl]propan-1-one CAS Name: 3-(2,5-dimethylphenoxy)-1-[4-[(3-fluorophenyl)-oxomethyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(2,5-dimethylphenoxy)-1-[4-(3-fluorobenzoyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(2,5-dimethylphenoxy)-1-[4-(3-fluorobenzoyl)piperazino]propan-1-one Formula: C22H25FN2O3 MolecularWeight: 384.443903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCC(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCC(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H25FN2O3/c1-16-6-7-17(2)20(14-16)28-13-8-21(26)24-9-11-25(12-10-24)22(27)18-4-3-5-19(23)15-18/h3-7,14-15H,8-13H2,1-2H3