[(2S)-1-(3-methoxy-4-oxidanyl-phenyl)-3-oxidanyl-3-oxidanylidene-1-tritio-propan-2-yl]azanium chloride

Systemtic Name: [(2S)-1-(3-methoxy-4-oxidanyl-phenyl)-3-oxidanyl-3-oxidanylidene-1-tritio-propan-2-yl]azanium chloride Openeye Name: [(1S)-1-carboxy-2-(4-hydroxy-3-methoxy-phenyl)-2-tritio-ethyl]ammonium chloride CAS Name: [(2S)-1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-3-tritiopropan-2-yl]ammonium chloride IUPAC Name: [(2S)-1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-3-tritiopropan-2-yl]azanium chloride Traditional Name: [(1S)-1-carboxy-2-(4-hydroxy-3-methoxy-phenyl)-2-tritio-ethyl]ammonium chloride Formula: C10H14ClNO4 MolecularWeight: 249.683569

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC(C(=O)O)[NH3+])O.[Cl-]

Isomeric SMILES

[3H]C(C1=CC(=C(C=C1)O)OC)[C@@H](C(=O)O)[NH3+].[Cl-]

InChI

InChI=1S/C10H13NO4.ClH/c1-15-9-5-6(2-3-8(9)12)4-7(11)10(13)14;/h2-3,5,7,12H,4,11H2,1H3,(H,13,14);1H/t7-;/m0./s1/i4T;/t4?,7-;