N-[2-[3-(1,4-dimethylpiperazin-1-ium-1-yl)propylsulfonyl-oxidanyl-amino]phenyl]ethanamide

Systemtic Name: N-[2-[3-(1,4-dimethylpiperazin-1-ium-1-yl)propylsulfonyl-oxidanyl-amino]phenyl]ethanamide Openeye Name: N-[2-[3-(1,4-dimethylpiperazin-1-ium-1-yl)propylsulfonyl-hydroxy-amino]phenyl]acetamide CAS Name: N-[2-[3-(1,4-dimethyl-1-piperazin-1-iumyl)propylsulfonyl-hydroxyamino]phenyl]acetamide IUPAC Name: N-[2-[3-(1,4-dimethylpiperazin-1-ium-1-yl)propylsulfonyl-hydroxyamino]phenyl]acetamide Traditional Name: N-[2-[3-(1,4-dimethylpiperazin-1-ium-1-yl)propylsulfonyl-hydroxy-amino]phenyl]acetamide Formula: C17H29N4O4S+ MolecularWeight: 385.50156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1N(O)S(=O)(=O)CCC[N+]2(CCN(CC2)C)C

Isomeric SMILES

CC(=O)NC1=CC=CC=C1N(O)S(=O)(=O)CCC[N+]2(CCN(CC2)C)C

InChI

InChI=1S/C17H28N4O4S/c1-15(22)18-16-7-4-5-8-17(16)20(23)26(24,25)14-6-11-21(3)12-9-19(2)10-13-21/h4-5,7-8,23H,6,9-14H2,1-3H3/p+1