2-[butyl-(2-oxidanyl-3-prop-2-enoxy-propyl)amino]ethanesulfonic acid

Systemtic Name: 2-[butyl-(2-oxidanyl-3-prop-2-enoxy-propyl)amino]ethanesulfonic acid Openeye Name: 2-[(3-allyloxy-2-hydroxy-propyl)-butyl-amino]ethanesulfonic acid CAS Name: 2-[butyl-(2-hydroxy-3-prop-2-enoxypropyl)amino]ethanesulfonic acid IUPAC Name: 2-[butyl-(2-hydroxy-3-prop-2-enoxypropyl)amino]ethanesulfonic acid Traditional Name: 2-[(3-allyloxy-2-hydroxy-propyl)-butyl-amino]ethanesulfonic acid Formula: C12H25NO5S MolecularWeight: 295.3956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCS(=O)(=O)O)CC(COCC=C)O

Isomeric SMILES

CCCCN(CCS(=O)(=O)O)CC(COCC=C)O

InChI

InChI=1S/C12H25NO5S/c1-3-5-6-13(7-9-19(15,16)17)10-12(14)11-18-8-4-2/h4,12,14H,2-3,5-11H2,1H3,(H,15,16,17)