N-methyl-2-(1-quinolin-8-ylsulfonylindol-4-yl)oxy-ethanamine; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-methyl-2-(1-quinolin-8-ylsulfonylindol-4-yl)oxy-ethanamine; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-methyl-2-[1-(8-quinolylsulfonyl)indol-4-yl]oxy-ethanamine; 2,2,2-trifluoroacetic acid CAS Name: N-methyl-2-[[1-(8-quinolinylsulfonyl)-4-indolyl]oxy]ethanamine; 2,2,2-trifluoroacetic acid IUPAC Name: N-methyl-2-(1-quinolin-8-ylsulfonylindol-4-yl)oxyethanamine; 2,2,2-trifluoroacetic acid Traditional Name: methyl-[2-[1-(8-quinolylsulfonyl)indol-4-yl]oxyethyl]amine; 2,2,2-trifluoroacetic acid Formula: C22H20F3N3O5S MolecularWeight: 495.47151

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNCCOC1=CC=CC2=C1C=CN2S(=O)(=O)C3=CC=CC4=C3N=CC=C4.C(=O)(C(F)(F)F)O

Isomeric SMILES

CNCCOC1=CC=CC2=C1C=CN2S(=O)(=O)C3=CC=CC4=C3N=CC=C4.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C20H19N3O3S.C2HF3O2/c1-21-12-14-26-18-8-3-7-17-16(18)10-13-23(17)27(24,25)19-9-2-5-15-6-4-11-22-20(15)19;3-2(4,5)1(6)7/h2-11,13,21H,12,14H2,1H3;(H,6,7)