N,N-diethyl-2-[4-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-diethyl-2-[4-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-diethyl-2-[4-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N,N-diethyl-2-[4-[4-(2-oxo-1-pyrrolidinyl)phenyl]sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-diethyl-2-[4-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N,N-diethyl-2-[4-[4-(2-ketopyrrolidino)phenyl]sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C20H31N4O4S+ MolecularWeight: 423.54954

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C20H30N4O4S/c1-3-22(4-2)20(26)16-21-12-14-23(15-13-21)29(27,28)18-9-7-17(8-10-18)24-11-5-6-19(24)25/h7-10H,3-6,11-16H2,1-2H3/p+1