N,N-dimethyl-2-[4-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-dimethyl-2-[4-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-dimethyl-2-[4-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-benzoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N,N-dimethyl-2-[4-[[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-dimethyl-2-[4-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylbenzoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-dimethyl-2-[4-(5-morpholinosulfonyl-2-pyrrolidino-benzoyl)piperazin-1-ium-1-yl]acetamide Formula: C23H36N5O5S+ MolecularWeight: 494.62744

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4

Isomeric SMILES

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4

InChI

InChI=1S/C23H35N5O5S/c1-24(2)22(29)18-25-9-11-27(12-10-25)23(30)20-17-19(5-6-21(20)26-7-3-4-8-26)34(31,32)28-13-15-33-16-14-28/h5-6,17H,3-4,7-16,18H2,1-2H3/p+1