5-[[1,3-benzodioxol-5-ylmethyl-(phenylmethyl)amino]methyl]-N-hexyl-furan-2-carboxamide

Systemtic Name: 5-[[1,3-benzodioxol-5-ylmethyl-(phenylmethyl)amino]methyl]-N-hexyl-furan-2-carboxamide Openeye Name: 5-[[1,3-benzodioxol-5-ylmethyl(benzyl)amino]methyl]-N-hexyl-furan-2-carboxamide CAS Name: 5-[[1,3-benzodioxol-5-ylmethyl-(phenylmethyl)amino]methyl]-N-hexyl-2-furancarboxamide IUPAC Name: 5-[[1,3-benzodioxol-5-ylmethyl(benzyl)amino]methyl]-N-hexylfuran-2-carboxamide Traditional Name: 5-[[benzyl(piperonyl)amino]methyl]-N-hexyl-2-furamide Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CC=C(O1)CN(CC2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCCCNC(=O)C1=CC=C(O1)CN(CC2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C27H32N2O4/c1-2-3-4-8-15-28-27(30)25-14-12-23(33-25)19-29(17-21-9-6-5-7-10-21)18-22-11-13-24-26(16-22)32-20-31-24/h5-7,9-14,16H,2-4,8,15,17-20H2,1H3,(H,28,30)