(E)-1-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]but-2-en-1-one

Systemtic Name: (E)-1-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]but-2-en-1-one Openeye Name: (E)-1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]but-2-en-1-one CAS Name: (E)-1-[4-(4-acetylphenyl)sulfonyl-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]but-2-en-1-one Traditional Name: (E)-1-[4-(4-acetylphenyl)sulfonylpiperazino]but-2-en-1-one Formula: C16H20N2O4S MolecularWeight: 336.406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

C/C=C/C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C16H20N2O4S/c1-3-4-16(20)17-9-11-18(12-10-17)23(21,22)15-7-5-14(6-8-15)13(2)19/h3-8H,9-12H2,1-2H3/b4-3+