1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2,5-dimethylphenoxy)butan-1-one

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2,5-dimethylphenoxy)butan-1-one Openeye Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2,5-dimethylphenoxy)butan-1-one CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-2-(2,5-dimethylphenoxy)-1-butanone IUPAC Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2,5-dimethylphenoxy)butan-1-one Traditional Name: 1-[4-(3-chlorophenyl)piperazino]-2-(2,5-dimethylphenoxy)butan-1-one Formula: C22H27ClN2O2 MolecularWeight: 386.91498

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)OC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)OC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C22H27ClN2O2/c1-4-20(27-21-14-16(2)8-9-17(21)3)22(26)25-12-10-24(11-13-25)19-7-5-6-18(23)15-19/h5-9,14-15,20H,4,10-13H2,1-3H3