3-(1-butyl-2-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-ethoxy-1H-indole; tris(fluoranyl)methanesulfonic acid

Systemtic Name: 3-(1-butyl-2-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-ethoxy-1H-indole; tris(fluoranyl)methanesulfonic acid Openeye Name: 3-(1-butyl-2-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-ethoxy-1H-indole; trifluoromethanesulfonic acid CAS Name: 3-(1-butyl-2-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-ethoxy-1H-indole; trifluoromethanesulfonic acid IUPAC Name: 3-(1-butyl-2-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-ethoxy-1H-indole; trifluoromethanesulfonic acid Traditional Name: 3-(1-butyl-2-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-ethoxy-1H-indole; triflic acid Formula: C21H29F3N2O4S MolecularWeight: 462.52617

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC=C(CC1C)C2=CNC3=C2C(=CC=C3)OCC.C(F)(F)(F)S(=O)(=O)O

Isomeric SMILES

CCCCN1CC=C(CC1C)C2=CNC3=C2C(=CC=C3)OCC.C(F)(F)(F)S(=O)(=O)O

InChI

InChI=1S/C20H28N2O.CHF3O3S/c1-4-6-11-22-12-10-16(13-15(22)3)17-14-21-18-8-7-9-19(20(17)18)23-5-2;2-1(3,4)8(5,6)7/h7-10,14-15,21H,4-6,11-13H2,1-3H3;(H,5,6,7)