1-methylsulfonyl-4-(pyridin-1-ium-4-ylmethyl)piperazin-4-ium

Systemtic Name: 1-methylsulfonyl-4-(pyridin-1-ium-4-ylmethyl)piperazin-4-ium Openeye Name: 1-methylsulfonyl-4-(pyridin-1-ium-4-ylmethyl)piperazin-4-ium CAS Name: 1-methylsulfonyl-4-(4-pyridin-1-iumylmethyl)piperazin-4-ium IUPAC Name: 1-methylsulfonyl-4-(pyridin-1-ium-4-ylmethyl)piperazin-4-ium Traditional Name: 1-mesyl-4-(pyridin-1-ium-4-ylmethyl)piperazin-4-ium Formula: C11H19N3O2S+2 MolecularWeight: 257.35246

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC[NH+](CC1)CC2=CC=[NH+]C=C2

Isomeric SMILES

CS(=O)(=O)N1CC[NH+](CC1)CC2=CC=[NH+]C=C2

InChI

InChI=1S/C11H17N3O2S/c1-17(15,16)14-8-6-13(7-9-14)10-11-2-4-12-5-3-11/h2-5H,6-10H2,1H3/p+2