ethanesulfonic acid; N-[3-[2-(methylamino)-1-oxidanyl-ethyl]phenyl]methanesulfonamide

Systemtic Name: ethanesulfonic acid; N-[3-[2-(methylamino)-1-oxidanyl-ethyl]phenyl]methanesulfonamide Openeye Name: ethanesulfonic acid; N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]methanesulfonamide CAS Name: ethanesulfonic acid; N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]methanesulfonamide IUPAC Name: ethanesulfonic acid; N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]methanesulfonamide Traditional Name: esylic acid; N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]methanesulfonamide Formula: C12H22N2O6S2 MolecularWeight: 354.44288

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)O.CNCC(C1=CC(=CC=C1)NS(=O)(=O)C)O

Isomeric SMILES

CCS(=O)(=O)O.CNCC(C1=CC(=CC=C1)NS(=O)(=O)C)O

InChI

InChI=1S/C10H16N2O3S.C2H6O3S/c1-11-7-10(13)8-4-3-5-9(6-8)12-16(2,14)15;1-2-6(3,4)5/h3-6,10-13H,7H2,1-2H3;2H2,1H3,(H,3,4,5)