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

Systemtic Name: 2-[2-octadecylsulfinylethyl-(2-oxidanyl-3-prop-2-enoxy-propyl)amino]ethanesulfonic acid Openeye Name: 2-[(3-allyloxy-2-hydroxy-propyl)-(2-octadecylsulfinylethyl)amino]ethanesulfonic acid CAS Name: 2-[(2-hydroxy-3-prop-2-enoxypropyl)-(2-octadecylsulfinylethyl)amino]ethanesulfonic acid IUPAC Name: 2-[(2-hydroxy-3-prop-2-enoxypropyl)-(2-octadecylsulfinylethyl)amino]ethanesulfonic acid Traditional Name: 2-[(3-allyloxy-2-hydroxy-propyl)-(2-stearylsulfinylethyl)amino]ethanesulfonic acid Formula: C28H57NO6S2 MolecularWeight: 567.88528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCS(=O)CCN(CCS(=O)(=O)O)CC(COCC=C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCS(=O)CCN(CCS(=O)(=O)O)CC(COCC=C)O

InChI

InChI=1S/C28H57NO6S2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-36(31)24-20-29(21-25-37(32,33)34)26-28(30)27-35-22-4-2/h4,28,30H,2-3,5-27H2,1H3,(H,32,33,34)