1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-(2-ethylphenoxy)ethanone

Systemtic Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-(2-ethylphenoxy)ethanone Openeye Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-(2-ethylphenoxy)ethanone CAS Name: 1-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-2-(2-ethylphenoxy)ethanone IUPAC Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-(2-ethylphenoxy)ethanone Traditional Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-2-(2-ethylphenoxy)ethanone Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCC1=CC=CC=C1OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C22H28N2O4S/c1-4-19-7-5-6-8-21(19)28-16-22(25)23-11-13-24(14-12-23)29(26,27)20-10-9-17(2)18(3)15-20/h5-10,15H,4,11-14,16H2,1-3H3