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

Systemtic Name: 2-(3-bromanylphenoxy)-1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(3-bromophenoxy)-1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(3-bromophenoxy)-1-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(3-bromophenoxy)-1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(3-bromophenoxy)-1-(4-p-phenetylsulfonylpiperazino)ethanone Formula: C20H23BrN2O5S MolecularWeight: 483.37602

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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)Br

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrN2O5S/c1-2-27-17-6-8-19(9-7-17)29(25,26)23-12-10-22(11-13-23)20(24)15-28-18-5-3-4-16(21)14-18/h3-9,14H,2,10-13,15H2,1H3