ethanedioic acid; 2-[5-(trifluoromethyloxy)-1H-indol-3-yl]ethanamine

Systemtic Name: ethanedioic acid; 2-[5-(trifluoromethyloxy)-1H-indol-3-yl]ethanamine Openeye Name: oxalic acid; 2-[5-(trifluoromethoxy)-1H-indol-3-yl]ethanamine CAS Name: oxalic acid; 2-[5-(trifluoromethoxy)-1H-indol-3-yl]ethanamine IUPAC Name: oxalic acid; 2-[5-(trifluoromethoxy)-1H-indol-3-yl]ethanamine Traditional Name: oxalic acid; 2-[5-(trifluoromethoxy)-1H-indol-3-yl]ethylamine Formula: C13H13F3N2O5 MolecularWeight: 334.24793

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OC(F)(F)F)C(=CN2)CCN.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC2=C(C=C1OC(F)(F)F)C(=CN2)CCN.C(=O)(C(=O)O)O

InChI

InChI=1S/C11H11F3N2O.C2H2O4/c12-11(13,14)17-8-1-2-10-9(5-8)7(3-4-15)6-16-10;3-1(4)2(5)6/h1-2,5-6,16H,3-4,15H2;(H,3,4)(H,5,6)