N-(1,3-benzodioxol-5-ylmethyl)-5-[[2-phenoxyethanoyl(1-phenylethyl)amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[2-phenoxyethanoyl(1-phenylethyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(2-phenoxyacetyl)-(1-phenylethyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(1-oxo-2-phenoxyethyl)-(1-phenylethyl)amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(2-phenoxyacetyl)-(1-phenylethyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[(2-phenoxyacetyl)-(1-phenylethyl)amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C29H27N3O6 MolecularWeight: 513.54118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC2=CC(=NO2)C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)COC5=CC=CC=C5

Isomeric SMILES

CC(C1=CC=CC=C1)N(CC2=CC(=NO2)C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)COC5=CC=CC=C5

InChI

InChI=1S/C29H27N3O6/c1-20(22-8-4-2-5-9-22)32(28(33)18-35-23-10-6-3-7-11-23)17-24-15-25(31-38-24)29(34)30-16-21-12-13-26-27(14-21)37-19-36-26/h2-15,20H,16-19H2,1H3,(H,30,34)