2-(4-chloranylphenoxy)-1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 2-(4-chloranylphenoxy)-1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 2-(4-chlorophenoxy)-1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-methyl-propan-1-one CAS Name: 2-(4-chlorophenoxy)-1-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 2-(4-chlorophenoxy)-1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-methylpropan-1-one Traditional Name: 2-(4-chlorophenoxy)-1-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-2-methyl-propan-1-one Formula: C22H27ClN2O4S MolecularWeight: 450.97878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C)(C)OC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C)(C)OC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C22H27ClN2O4S/c1-16-5-10-20(15-17(16)2)30(27,28)25-13-11-24(12-14-25)21(26)22(3,4)29-19-8-6-18(23)7-9-19/h5-10,15H,11-14H2,1-4H3