1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-(3-propan-2-ylphenoxy)ethanone

Systemtic Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-(3-propan-2-ylphenoxy)ethanone Openeye Name: 2-(3-isopropylphenoxy)-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-(3-propan-2-ylphenoxy)ethanone IUPAC Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-(3-propan-2-ylphenoxy)ethanone Traditional Name: 2-(3-isopropylphenoxy)-1-(4-tosylpiperazino)ethanone Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=CC(=C3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=CC(=C3)C(C)C

InChI

InChI=1S/C22H28N2O4S/c1-17(2)19-5-4-6-20(15-19)28-16-22(25)23-11-13-24(14-12-23)29(26,27)21-9-7-18(3)8-10-21/h4-10,15,17H,11-14,16H2,1-3H3