methyl sulfate; trimethyl-[2-(4-oxidanyl-1H-indol-3-yl)ethyl]azanium

Systemtic Name: methyl sulfate; trimethyl-[2-(4-oxidanyl-1H-indol-3-yl)ethyl]azanium Openeye Name: 2-(4-hydroxy-1H-indol-3-yl)ethyl-trimethyl-ammonium; methyl sulfate CAS Name: 2-(4-hydroxy-1H-indol-3-yl)ethyl-trimethylammonium; methyl sulfate IUPAC Name: 2-(4-hydroxy-1H-indol-3-yl)ethyl-trimethylazanium; methyl sulfate Traditional Name: 2-(4-hydroxy-1H-indol-3-yl)ethyl-trimethyl-ammonium; methyl sulfate Formula: C14H22N2O5S MolecularWeight: 330.39988

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCC1=CNC2=C1C(=CC=C2)O.COS(=O)(=O)[O-]

Isomeric SMILES

C[N+](C)(C)CCC1=CNC2=C1C(=CC=C2)O.COS(=O)(=O)[O-]

InChI

InChI=1S/C13H18N2O.CH4O4S/c1-15(2,3)8-7-10-9-14-11-5-4-6-12(16)13(10)11;1-5-6(2,3)4/h4-6,9,14H,7-8H2,1-3H3;1H3,(H,2,3,4)