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

Systemtic Name: (3-chloranyl-2-oxidanyl-propyl)-trimethyl-azanium sulfate Openeye Name: (3-chloro-2-hydroxy-propyl)-trimethyl-ammonium sulfate CAS Name: (3-chloro-2-hydroxypropyl)-trimethylammonium sulfate IUPAC Name: (3-chloro-2-hydroxypropyl)-trimethylazanium sulfate Traditional Name: (3-chloro-2-hydroxy-propyl)-trimethyl-ammonium sulfate Formula: C12H30Cl2N2O6S MolecularWeight: 401.3474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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