2-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanoylamino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanoylamino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]-N-isopropyl-acetamide CAS Name: 2-[[2-[4-(3-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-1-oxoethyl]amino]-N-propan-2-ylacetamide IUPAC Name: 2-[[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]-N-propan-2-ylacetamide Traditional Name: 2-[[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]-N-isopropyl-acetamide Formula: C17H26FN4O4S+ MolecularWeight: 401.476143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)F

Isomeric SMILES

CC(C)NC(=O)CNC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)F

InChI

InChI=1S/C17H25FN4O4S/c1-13(2)20-16(23)11-19-17(24)12-21-6-8-22(9-7-21)27(25,26)15-5-3-4-14(18)10-15/h3-5,10,13H,6-9,11-12H2,1-2H3,(H,19,24)(H,20,23)/p+1