trimethyl-(3-methylsulfonyl-4-oxidanyl-4-oxidanylidene-2-phenylmethoxy-butyl)azanium

Systemtic Name: trimethyl-(3-methylsulfonyl-4-oxidanyl-4-oxidanylidene-2-phenylmethoxy-butyl)azanium Openeye Name: (2-benzyloxy-4-hydroxy-3-methylsulfonyl-4-oxo-butyl)-trimethyl-ammonium CAS Name: (4-hydroxy-3-methylsulfonyl-4-oxo-2-phenylmethoxybutyl)-trimethylammonium IUPAC Name: (4-hydroxy-3-methylsulfonyl-4-oxo-2-phenylmethoxybutyl)-trimethylazanium Traditional Name: (2-benzoxy-4-hydroxy-4-keto-3-mesyl-butyl)-trimethyl-ammonium Formula: C15H24NO5S+ MolecularWeight: 330.41976

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(C(C(=O)O)S(=O)(=O)C)OCC1=CC=CC=C1

Isomeric SMILES

C[N+](C)(C)CC(C(C(=O)O)S(=O)(=O)C)OCC1=CC=CC=C1

InChI

InChI=1S/C15H23NO5S/c1-16(2,3)10-13(14(15(17)18)22(4,19)20)21-11-12-8-6-5-7-9-12/h5-9,13-14H,10-11H2,1-4H3/p+1