1-butyl-4-(4-ethoxy-1-benzothiophen-3-yl)piperidine; tris(fluoranyl)methanesulfonic acid

Systemtic Name: 1-butyl-4-(4-ethoxy-1-benzothiophen-3-yl)piperidine; tris(fluoranyl)methanesulfonic acid Openeye Name: 1-butyl-4-(4-ethoxybenzothiophen-3-yl)piperidine; trifluoromethanesulfonic acid CAS Name: 1-butyl-4-(4-ethoxy-1-benzothiophen-3-yl)piperidine; trifluoromethanesulfonic acid IUPAC Name: 1-butyl-4-(4-ethoxy-1-benzothiophen-3-yl)piperidine; trifluoromethanesulfonic acid Traditional Name: 1-butyl-4-(4-ethoxybenzothiophen-3-yl)piperidine; triflic acid Formula: C20H28F3NO4S2 MolecularWeight: 467.56583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)C2=CSC3=CC=CC(=C32)OCC.C(F)(F)(F)S(=O)(=O)O

Isomeric SMILES

CCCCN1CCC(CC1)C2=CSC3=CC=CC(=C32)OCC.C(F)(F)(F)S(=O)(=O)O

InChI

InChI=1S/C19H27NOS.CHF3O3S/c1-3-5-11-20-12-9-15(10-13-20)16-14-22-18-8-6-7-17(19(16)18)21-4-2;2-1(3,4)8(5,6)7/h6-8,14-15H,3-5,9-13H2,1-2H3;(H,5,6,7)