N,N-bis(cyanomethyl)piperazin-4-ium-1-sulfonamide

Systemtic Name: N,N-bis(cyanomethyl)piperazin-4-ium-1-sulfonamide Openeye Name: N,N-bis(cyanomethyl)piperazin-4-ium-1-sulfonamide CAS Name: N,N-bis(cyanomethyl)-1-piperazin-4-iumsulfonamide IUPAC Name: N,N-bis(cyanomethyl)piperazin-4-ium-1-sulfonamide Traditional Name: N,N-bis(cyanomethyl)piperazin-4-ium-1-sulfonamide Formula: C8H14N5O2S+ MolecularWeight: 244.29406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)N(CC#N)CC#N

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)N(CC#N)CC#N

InChI

InChI=1S/C8H13N5O2S/c9-1-5-12(6-2-10)16(14,15)13-7-3-11-4-8-13/h11H,3-8H2/p+1