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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclopropylcarbonyl(2-methylbutyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclopropanecarbonyl(2-methylbutyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[[cyclopropyl(oxo)methyl]-(2-methylbutyl)amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclopropanecarbonyl(2-methylbutyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[cyclopropanecarbonyl(2-methylbutyl)amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4CC4

Isomeric SMILES

CCC(C)CN(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4CC4

InChI

InChI=1S/C22H27N3O5/c1-3-14(2)11-25(22(27)16-5-6-16)12-17-9-18(24-30-17)21(26)23-10-15-4-7-19-20(8-15)29-13-28-19/h4,7-9,14,16H,3,5-6,10-13H2,1-2H3,(H,23,26)