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

Systemtic Name: 3-(3-bromanylphenoxy)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(3-bromophenoxy)-1-[4-[(E)-styryl]sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(3-bromophenoxy)-1-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-(3-bromophenoxy)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(3-bromophenoxy)-1-[4-[(E)-styryl]sulfonylpiperazino]propan-1-one Formula: C21H23BrN2O4S MolecularWeight: 479.38732

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCOC2=CC(=CC=C2)Br)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CCOC2=CC(=CC=C2)Br)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H23BrN2O4S/c22-19-7-4-8-20(17-19)28-15-9-21(25)23-11-13-24(14-12-23)29(26,27)16-10-18-5-2-1-3-6-18/h1-8,10,16-17H,9,11-15H2/b16-10+