2-(5-methoxy-1H-indol-3-yl)ethylazanium ethanoate

Systemtic Name: 2-(5-methoxy-1H-indol-3-yl)ethylazanium ethanoate Openeye Name: 2-(5-methoxy-1H-indol-3-yl)ethylammonium acetate CAS Name: 2-(5-methoxy-1H-indol-3-yl)ethylammonium acetate IUPAC Name: 2-(5-methoxy-1H-indol-3-yl)ethylazanium acetate Traditional Name: 2-(5-methoxy-1H-indol-3-yl)ethylammonium acetate Formula: C13H18N2O3 MolecularWeight: 250.29362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].COC1=CC2=C(C=C1)NC=C2CC[NH3+]

Isomeric SMILES

CC(=O)[O-].COC1=CC2=C(C=C1)NC=C2CC[NH3+]

InChI

InChI=1S/C11H14N2O.C2H4O2/c1-14-9-2-3-11-10(6-9)8(4-5-12)7-13-11;1-2(3)4/h2-3,6-7,13H,4-5,12H2,1H3;1H3,(H,3,4)