2-(1-butylpiperidin-4-yl)-5-ethoxy-1H-indole; tris(fluoranyl)methanesulfonic acid

Systemtic Name: 2-(1-butylpiperidin-4-yl)-5-ethoxy-1H-indole; tris(fluoranyl)methanesulfonic acid Openeye Name: 2-(1-butyl-4-piperidyl)-5-ethoxy-1H-indole; trifluoromethanesulfonic acid CAS Name: 2-(1-butyl-4-piperidinyl)-5-ethoxy-1H-indole; trifluoromethanesulfonic acid IUPAC Name: 2-(1-butylpiperidin-4-yl)-5-ethoxy-1H-indole; trifluoromethanesulfonic acid Traditional Name: 2-(1-butyl-4-piperidyl)-5-ethoxy-1H-indole; triflic acid Formula: C20H29F3N2O4S MolecularWeight: 450.51547

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)C2=CC3=C(N2)C=CC(=C3)OCC.C(F)(F)(F)S(=O)(=O)O

Isomeric SMILES

CCCCN1CCC(CC1)C2=CC3=C(N2)C=CC(=C3)OCC.C(F)(F)(F)S(=O)(=O)O

InChI

InChI=1S/C19H28N2O.CHF3O3S/c1-3-5-10-21-11-8-15(9-12-21)19-14-16-13-17(22-4-2)6-7-18(16)20-19;2-1(3,4)8(5,6)7/h6-7,13-15,20H,3-5,8-12H2,1-2H3;(H,5,6,7)