1-propylsulfonyl-4-pyridin-1-ium-2-yl-piperazine

Systemtic Name: 1-propylsulfonyl-4-pyridin-1-ium-2-yl-piperazine Openeye Name: 1-propylsulfonyl-4-pyridin-1-ium-2-yl-piperazine CAS Name: 1-propylsulfonyl-4-(2-pyridin-1-iumyl)piperazine IUPAC Name: 1-propylsulfonyl-4-pyridin-1-ium-2-ylpiperazine Traditional Name: 1-propylsulfonyl-4-pyridin-1-ium-2-yl-piperazine Formula: C12H20N3O2S+ MolecularWeight: 270.3711

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=[NH+]2

Isomeric SMILES

CCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=[NH+]2

InChI

InChI=1S/C12H19N3O2S/c1-2-11-18(16,17)15-9-7-14(8-10-15)12-5-3-4-6-13-12/h3-6H,2,7-11H2,1H3/p+1