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

Systemtic Name: 1-propyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-propyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-piperazin-1-ium CAS Name: 1-propyl-4-[4-(1-pyrrolidinylsulfonyl)phenyl]sulfonylpiperazin-1-ium IUPAC Name: 1-propyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-propyl-4-(4-pyrrolidinosulfonylphenyl)sulfonyl-piperazin-1-ium Formula: C17H28N3O4S2+ MolecularWeight: 402.55192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O4S2/c1-2-9-18-12-14-20(15-13-18)26(23,24)17-7-5-16(6-8-17)25(21,22)19-10-3-4-11-19/h5-8H,2-4,9-15H2,1H3/p+1