1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-(3-methylphenoxy)ethanone

Systemtic Name: 1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-(3-methylphenoxy)ethanone Openeye Name: 1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-(3-methylphenoxy)ethanone CAS Name: 1-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-2-(3-methylphenoxy)ethanone IUPAC Name: 1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-(3-methylphenoxy)ethanone Traditional Name: 2-(3-methylphenoxy)-1-(4-p-phenetylsulfonylpiperazino)ethanone Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=CC(=C3)C

InChI

InChI=1S/C21H26N2O5S/c1-3-27-18-7-9-20(10-8-18)29(25,26)23-13-11-22(12-14-23)21(24)16-28-19-6-4-5-17(2)15-19/h4-10,15H,3,11-14,16H2,1-2H3