2-(3,4,5-trimethoxyphenyl)ethylazanium sulfate

Systemtic Name: 2-(3,4,5-trimethoxyphenyl)ethylazanium sulfate Openeye Name: 2-(3,4,5-trimethoxyphenyl)ethylammonium sulfate CAS Name: 2-(3,4,5-trimethoxyphenyl)ethylammonium sulfate IUPAC Name: 2-(3,4,5-trimethoxyphenyl)ethylazanium sulfate Traditional Name: 2-(3,4,5-trimethoxyphenyl)ethylammonium sulfate Formula: C22H36N2O10S MolecularWeight: 520.59364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC[NH3+].COC1=CC(=CC(=C1OC)OC)CC[NH3+].[O-]S(=O)(=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC[NH3+].COC1=CC(=CC(=C1OC)OC)CC[NH3+].[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C11H17NO3.H2O4S/c2*1-13-9-6-8(4-5-12)7-10(14-2)11(9)15-3;1-5(2,3)4/h2*6-7H,4-5,12H2,1-3H3;(H2,1,2,3,4)