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

Systemtic Name: 2-(3,4,5-trimethoxyphenyl)ethanamine sulfate Openeye Name: 2-(3,4,5-trimethoxyphenyl)ethanamine sulfate CAS Name: 2-(3,4,5-trimethoxyphenyl)ethanamine sulfate IUPAC Name: 2-(3,4,5-trimethoxyphenyl)ethanamine sulfate Traditional Name: 2-(3,4,5-trimethoxyphenyl)ethylamine sulfate Formula: C11H17NO7S-2 MolecularWeight: 307.32018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17NO3.H2O4S/c1-13-9-6-8(4-5-12)7-10(14-2)11(9)15-3;1-5(2,3)4/h6-7H,4-5,12H2,1-3H3;(H2,1,2,3,4)/p-2