N-[[1-(phenylmethyl)piperidin-3-yl]methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide

Systemtic Name: N-[[1-(phenylmethyl)piperidin-3-yl]methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide Openeye Name: N-[(1-benzyl-3-piperidyl)methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide CAS Name: 6-[(1-oxo-3,3,3-triphenylpropyl)amino]-N-[[1-(phenylmethyl)-3-piperidinyl]methyl]hexanamide IUPAC Name: N-[(1-benzylpiperidin-3-yl)methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide Traditional Name: N-[(1-benzyl-3-piperidyl)methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide Formula: C40H47N3O2 MolecularWeight: 601.82008

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=CC=C2)CNC(=O)CCCCCNC(=O)CC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC(CN(C1)CC2=CC=CC=C2)CNC(=O)CCCCCNC(=O)CC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C40H47N3O2/c44-38(42-30-34-19-16-28-43(32-34)31-33-17-6-1-7-18-33)26-14-5-15-27-41-39(45)29-40(35-20-8-2-9-21-35,36-22-10-3-11-23-36)37-24-12-4-13-25-37/h1-4,6-13,17-18,20-25,34H,5,14-16,19,26-32H2,(H,41,45)(H,42,44)