1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-2-(4-pyrrolidin-1-ylsulfonylphenoxy)ethanone

Systemtic Name: 1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-2-(4-pyrrolidin-1-ylsulfonylphenoxy)ethanone Openeye Name: 1-[4-[(E)-cinnamyl]piperazin-1-yl]-2-(4-pyrrolidin-1-ylsulfonylphenoxy)ethanone CAS Name: 1-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]-2-[4-(1-pyrrolidinylsulfonyl)phenoxy]ethanone IUPAC Name: 1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-2-(4-pyrrolidin-1-ylsulfonylphenoxy)ethanone Traditional Name: 1-[4-[(E)-cinnamyl]piperazino]-2-(4-pyrrolidinosulfonylphenoxy)ethanone Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H31N3O4S/c29-25(27-19-17-26(18-20-27)14-6-9-22-7-2-1-3-8-22)21-32-23-10-12-24(13-11-23)33(30,31)28-15-4-5-16-28/h1-3,6-13H,4-5,14-21H2/b9-6+