1-(4-propylpiperazin-4-ium-1-yl)sulfonyl-1,4-diazepan-4-ium

Systemtic Name: 1-(4-propylpiperazin-4-ium-1-yl)sulfonyl-1,4-diazepan-4-ium Openeye Name: 1-(4-propylpiperazin-4-ium-1-yl)sulfonyl-1,4-diazepan-4-ium CAS Name: 1-[(4-propyl-1-piperazin-4-iumyl)sulfonyl]-1,4-diazepan-4-ium IUPAC Name: 1-(4-propylpiperazin-4-ium-1-yl)sulfonyl-1,4-diazepan-4-ium Traditional Name: 1-(4-propylpiperazin-4-ium-1-yl)sulfonyl-1,4-diazepan-4-ium Formula: C12H28N4O2S+2 MolecularWeight: 292.44132

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)S(=O)(=O)N2CCC[NH2+]CC2

Isomeric SMILES

CCC[NH+]1CCN(CC1)S(=O)(=O)N2CCC[NH2+]CC2

InChI

InChI=1S/C12H26N4O2S/c1-2-6-14-9-11-16(12-10-14)19(17,18)15-7-3-4-13-5-8-15/h13H,2-12H2,1H3/p+2