2-(4-chloranyl-3-methyl-phenoxy)-1-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-1-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-2-(4-chloro-3-methyl-phenoxy)ethanone CAS Name: 1-[4-(4-acetylphenyl)sulfonyl-1-piperazinyl]-2-(4-chloro-3-methylphenoxy)ethanone IUPAC Name: 1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-2-(4-chloro-3-methylphenoxy)ethanone Traditional Name: 1-[4-(4-acetylphenyl)sulfonylpiperazino]-2-(4-chloro-3-methyl-phenoxy)ethanone Formula: C21H23ClN2O5S MolecularWeight: 450.93572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN2O5S/c1-15-13-18(5-8-20(15)22)29-14-21(26)23-9-11-24(12-10-23)30(27,28)19-6-3-17(4-7-19)16(2)25/h3-8,13H,9-12,14H2,1-2H3