1-ethyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-ethyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-ethyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-piperazin-1-ium CAS Name: 1-ethyl-4-[4-(1-pyrrolidinylsulfonyl)phenyl]sulfonylpiperazin-1-ium IUPAC Name: 1-ethyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-ethyl-4-(4-pyrrolidinosulfonylphenyl)sulfonyl-piperazin-1-ium Formula: C16H26N3O4S2+ MolecularWeight: 388.52534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O4S2/c1-2-17-11-13-19(14-12-17)25(22,23)16-7-5-15(6-8-16)24(20,21)18-9-3-4-10-18/h5-8H,2-4,9-14H2,1H3/p+1