(2S)-1-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2-(3-methylphenoxy)propan-1-one

Systemtic Name: (2S)-1-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2-(3-methylphenoxy)propan-1-one Openeye Name: (2S)-1-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2-(3-methylphenoxy)propan-1-one CAS Name: (2S)-1-[4-(2-chlorophenyl)sulfonyl-1-piperazinyl]-2-(3-methylphenoxy)-1-propanone IUPAC Name: (2S)-1-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2-(3-methylphenoxy)propan-1-one Traditional Name: (2S)-1-[4-(2-chlorophenyl)sulfonylpiperazino]-2-(3-methylphenoxy)propan-1-one Formula: C20H23ClN2O4S MolecularWeight: 422.92562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC(=CC=C1)O[C@@H](C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H23ClN2O4S/c1-15-6-5-7-17(14-15)27-16(2)20(24)22-10-12-23(13-11-22)28(25,26)19-9-4-3-8-18(19)21/h3-9,14,16H,10-13H2,1-2H3/t16-/m0/s1