(1-chloranyl-2-oxidanyl-propyl)-trimethyl-azanium sulfate

Systemtic Name: (1-chloranyl-2-oxidanyl-propyl)-trimethyl-azanium sulfate Openeye Name: (1-chloro-2-hydroxy-propyl)-trimethyl-ammonium sulfate CAS Name: (1-chloro-2-hydroxypropyl)-trimethylammonium sulfate IUPAC Name: (1-chloro-2-hydroxypropyl)-trimethylazanium sulfate Traditional Name: (1-chloro-2-hydroxy-propyl)-trimethyl-ammonium sulfate Formula: C12H30Cl2N2O6S MolecularWeight: 401.3474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C([N+](C)(C)C)Cl)O.CC(C([N+](C)(C)C)Cl)O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC(C([N+](C)(C)C)Cl)O.CC(C([N+](C)(C)C)Cl)O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C6H15ClNO.H2O4S/c2*1-5(9)6(7)8(2,3)4;1-5(2,3)4/h2*5-6,9H,1-4H3;(H2,1,2,3,4)/q2*+1;/p-2