2-(2-chloranylprop-2-enoylamino)ethanesulfonic acid; 1-(2-oxidanylpropylamino)propan-2-ol

Systemtic Name: 2-(2-chloranylprop-2-enoylamino)ethanesulfonic acid; 1-(2-oxidanylpropylamino)propan-2-ol Openeye Name: 2-(2-chloroprop-2-enoylamino)ethanesulfonic acid; 1-(2-hydroxypropylamino)propan-2-ol CAS Name: 2-[(2-chloro-1-oxoprop-2-enyl)amino]ethanesulfonic acid; 1-(2-hydroxypropylamino)-2-propanol IUPAC Name: 2-(2-chloroprop-2-enoylamino)ethanesulfonic acid; 1-(2-hydroxypropylamino)propan-2-ol Traditional Name: 2-[(2-chloroacryloyl)amino]ethanesulfonic acid; 1-(2-hydroxypropylamino)propan-2-ol Formula: C11H23ClN2O6S MolecularWeight: 346.82812

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNCC(C)O)O.C=C(C(=O)NCCS(=O)(=O)O)Cl

Isomeric SMILES

CC(CNCC(C)O)O.C=C(C(=O)NCCS(=O)(=O)O)Cl

InChI

InChI=1S/C6H15NO2.C5H8ClNO4S/c1-5(8)3-7-4-6(2)9;1-4(6)5(8)7-2-3-12(9,10)11/h5-9H,3-4H2,1-2H3;1-3H2,(H,7,8)(H,9,10,11)