(E)-3-(4-fluorophenyl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate

Systemtic Name: (E)-3-(4-fluorophenyl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate Openeye Name: (E)-3-(4-fluorophenyl)-2-[5-(1-piperidylsulfonyl)-2-thienyl]prop-2-enoate CAS Name: (E)-3-(4-fluorophenyl)-2-[5-(1-piperidinylsulfonyl)-2-thiophenyl]-2-propenoate IUPAC Name: (E)-3-(4-fluorophenyl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(4-fluorophenyl)-2-(5-piperidinosulfonyl-2-thienyl)acrylate Formula: C18H17FNO4S2- MolecularWeight: 394.460283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)C(=CC3=CC=C(C=C3)F)C(=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)/C(=C/C3=CC=C(C=C3)F)/C(=O)[O-]

InChI

InChI=1S/C18H18FNO4S2/c19-14-6-4-13(5-7-14)12-15(18(21)22)16-8-9-17(25-16)26(23,24)20-10-2-1-3-11-20/h4-9,12H,1-3,10-11H2,(H,21,22)/p-1/b15-12-