3-[[3-(1-hydroxyethyl)-2,4-bis(oxidanyl)pentan-3-yl]amino]-2-oxidanyl-propane-1-sulfonic acid

Systemtic Name: 3-[[3-(1-hydroxyethyl)-2,4-bis(oxidanyl)pentan-3-yl]amino]-2-oxidanyl-propane-1-sulfonic acid Openeye Name: 2-hydroxy-3-[[2-hydroxy-1,1-bis(1-hydroxyethyl)propyl]amino]propane-1-sulfonic acid CAS Name: 3-[[2,4-dihydroxy-3-(1-hydroxyethyl)pentan-3-yl]amino]-2-hydroxy-1-propanesulfonic acid IUPAC Name: 3-[[2,4-dihydroxy-3-(1-hydroxyethyl)pentan-3-yl]amino]-2-hydroxypropane-1-sulfonic acid Traditional Name: 2-hydroxy-3-[[2-hydroxy-1,1-bis(1-hydroxyethyl)propyl]amino]propane-1-sulfonic acid Formula: C10H23NO7S MolecularWeight: 301.35712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C)O)(C(C)O)NCC(CS(=O)(=O)O)O)O

Isomeric SMILES

CC(C(C(C)O)(C(C)O)NCC(CS(=O)(=O)O)O)O

InChI

InChI=1S/C10H23NO7S/c1-6(12)10(7(2)13,8(3)14)11-4-9(15)5-19(16,17)18/h6-9,11-15H,4-5H2,1-3H3,(H,16,17,18)