N-[[1-ethyl-1-(2-methylbutyl)piperidin-1-ium-3-yl]methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide

Systemtic Name: N-[[1-ethyl-1-(2-methylbutyl)piperidin-1-ium-3-yl]methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide Openeye Name: N-[[1-ethyl-1-(2-methylbutyl)piperidin-1-ium-3-yl]methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide CAS Name: N-[[1-ethyl-1-(2-methylbutyl)-3-piperidin-1-iumyl]methyl]-6-[(1-oxo-3,3,3-triphenylpropyl)amino]hexanamide IUPAC Name: N-[[1-ethyl-1-(2-methylbutyl)piperidin-1-ium-3-yl]methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide Traditional Name: N-[[1-ethyl-1-(2-methylbutyl)piperidin-1-ium-3-yl]methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide Formula: C40H56N3O2+ MolecularWeight: 610.89154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C[N+]1(CCCC(C1)CNC(=O)CCCCCNC(=O)CC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)CC

Isomeric SMILES

CCC(C)C[N+]1(CCCC(C1)CNC(=O)CCCCCNC(=O)CC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)CC

InChI

InChI=1S/C40H55N3O2/c1-4-33(3)31-43(5-2)28-18-19-34(32-43)30-42-38(44)26-16-9-17-27-41-39(45)29-40(35-20-10-6-11-21-35,36-22-12-7-13-23-36)37-24-14-8-15-25-37/h6-8,10-15,20-25,33-34H,4-5,9,16-19,26-32H2,1-3H3,(H-,41,42,44,45)/p+1