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

Systemtic Name: N-[(1-butylpiperidin-3-yl)methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide Openeye Name: N-[(1-butyl-3-piperidyl)methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide CAS Name: N-[(1-butyl-3-piperidinyl)methyl]-6-[(1-oxo-3,3,3-triphenylpropyl)amino]hexanamide IUPAC Name: N-[(1-butylpiperidin-3-yl)methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide Traditional Name: N-[(1-butyl-3-piperidyl)methyl]-6-(3,3,3-triphenylpropanoylamino)hexanamide Formula: C37H49N3O2 MolecularWeight: 567.80386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCC(C1)CNC(=O)CCCCCNC(=O)CC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN1CCCC(C1)CNC(=O)CCCCCNC(=O)CC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C37H49N3O2/c1-2-3-26-40-27-16-17-31(30-40)29-39-35(41)24-14-7-15-25-38-36(42)28-37(32-18-8-4-9-19-32,33-20-10-5-11-21-33)34-22-12-6-13-23-34/h4-6,8-13,18-23,31H,2-3,7,14-17,24-30H2,1H3,(H,38,42)(H,39,41)