2-oxidanyl-3-[4-(2-oxidanyl-3-sulfo-propyl)piperazin-1-yl]propane-1-sulfonic acid; sodium

Systemtic Name: 2-oxidanyl-3-[4-(2-oxidanyl-3-sulfo-propyl)piperazin-1-yl]propane-1-sulfonic acid; sodium Openeye Name: 2-hydroxy-3-[4-(2-hydroxy-3-sulfo-propyl)piperazin-1-yl]propane-1-sulfonic acid; sodium CAS Name: 2-hydroxy-3-[4-(2-hydroxy-3-sulfopropyl)-1-piperazinyl]-1-propanesulfonic acid; sodium IUPAC Name: 2-hydroxy-3-[4-(2-hydroxy-3-sulfopropyl)piperazin-1-yl]propane-1-sulfonic acid; sodium Traditional Name: 2-hydroxy-3-[4-(2-hydroxy-3-sulfo-propyl)piperazino]propane-1-sulfonic acid; sodium Formula: C10H22N2NaO8S2 MolecularWeight: 385.41005

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CS(=O)(=O)O)O)CC(CS(=O)(=O)O)O.[Na]

Isomeric SMILES

C1CN(CCN1CC(CS(=O)(=O)O)O)CC(CS(=O)(=O)O)O.[Na]

InChI

InChI=1S/C10H22N2O8S2.Na/c13-9(7-21(15,16)17)5-11-1-2-12(4-3-11)6-10(14)8-22(18,19)20;/h9-10,13-14H,1-8H2,(H,15,16,17)(H,18,19,20);