2-[4-(2-sulfonatoethyl)-1,4-diazepan-1-ium-1-yl]ethanesulfonate

Systemtic Name: 2-[4-(2-sulfonatoethyl)-1,4-diazepan-1-ium-1-yl]ethanesulfonate Openeye Name: 2-[4-(2-sulfonatoethyl)-1,4-diazepan-1-ium-1-yl]ethanesulfonate CAS Name: 2-[4-(2-sulfonatoethyl)-1,4-diazepan-1-ium-1-yl]ethanesulfonate IUPAC Name: 2-[4-(2-sulfonatoethyl)-1,4-diazepan-1-ium-1-yl]ethanesulfonate Traditional Name: 2-[4-(2-sulfonatoethyl)-1,4-diazepan-1-ium-1-yl]ethanesulfonate Formula: C9H19N2O6S2- MolecularWeight: 315.38696

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCN(C1)CCS(=O)(=O)[O-])CCS(=O)(=O)[O-]

Isomeric SMILES

C1C[NH+](CCN(C1)CCS(=O)(=O)[O-])CCS(=O)(=O)[O-]

InChI

InChI=1S/C9H20N2O6S2/c12-18(13,14)8-6-10-2-1-3-11(5-4-10)7-9-19(15,16)17/h1-9H2,(H,12,13,14)(H,15,16,17)/p-1