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

Systemtic Name: 2-(3-bromanylphenoxy)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(3-bromophenoxy)-1-[4-[(E)-styryl]sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(3-bromophenoxy)-1-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(3-bromophenoxy)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(3-bromophenoxy)-1-[4-[(E)-styryl]sulfonylpiperazino]ethanone Formula: C20H21BrN2O4S MolecularWeight: 465.36074

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=CC(=CC=C2)Br)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)COC2=CC(=CC=C2)Br)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H21BrN2O4S/c21-18-7-4-8-19(15-18)27-16-20(24)22-10-12-23(13-11-22)28(25,26)14-9-17-5-2-1-3-6-17/h1-9,14-15H,10-13,16H2/b14-9+