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

Systemtic Name: N-[4-[3-(1,4-dimethylpiperazin-1-ium-1-yl)propylsulfonyl-oxidanyl-amino]-2-methoxy-phenyl]ethanamide Openeye Name: N-[4-[3-(1,4-dimethylpiperazin-1-ium-1-yl)propylsulfonyl-hydroxy-amino]-2-methoxy-phenyl]acetamide CAS Name: N-[4-[3-(1,4-dimethyl-1-piperazin-1-iumyl)propylsulfonyl-hydroxyamino]-2-methoxyphenyl]acetamide IUPAC Name: N-[4-[3-(1,4-dimethylpiperazin-1-ium-1-yl)propylsulfonyl-hydroxyamino]-2-methoxyphenyl]acetamide Traditional Name: N-[4-[3-(1,4-dimethylpiperazin-1-ium-1-yl)propylsulfonyl-hydroxy-amino]-2-methoxy-phenyl]acetamide Formula: C18H31N4O5S+ MolecularWeight: 415.52754

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)N(O)S(=O)(=O)CCC[N+]2(CCN(CC2)C)C)OC

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)N(O)S(=O)(=O)CCC[N+]2(CCN(CC2)C)C)OC

InChI

InChI=1S/C18H30N4O5S/c1-15(23)19-17-7-6-16(14-18(17)27-4)21(24)28(25,26)13-5-10-22(3)11-8-20(2)9-12-22/h6-7,14,24H,5,8-13H2,1-4H3/p+1