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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl(2-phenoxyethanoyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(2-phenoxyacetyl)-sec-butyl-amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-(1-oxo-2-phenoxyethyl)amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-(2-phenoxyacetyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[(2-phenoxyacetyl)-sec-butyl-amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C25H27N3O6 MolecularWeight: 465.49838

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)COC4=CC=CC=C4

Isomeric SMILES

CCC(C)N(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)COC4=CC=CC=C4

InChI

InChI=1S/C25H27N3O6/c1-3-17(2)28(24(29)15-31-19-7-5-4-6-8-19)14-20-12-21(27-34-20)25(30)26-13-18-9-10-22-23(11-18)33-16-32-22/h4-12,17H,3,13-16H2,1-2H3,(H,26,30)