N-[1-(1,3-benzodioxol-5-ylmethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-5-(2,5-dimethylphenyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-ylmethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-5-(2,5-dimethylphenyl)-1,2-oxazole-3-carboxamide Openeye Name: N-[1-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2-methyl-propyl]-5-(2,5-dimethylphenyl)isoxazole-3-carboxamide CAS Name: N-[1-(1,3-benzodioxol-5-ylmethylamino)-3-methyl-1-oxobutan-2-yl]-5-(2,5-dimethylphenyl)-3-isoxazolecarboxamide IUPAC Name: N-[1-(1,3-benzodioxol-5-ylmethylamino)-3-methyl-1-oxobutan-2-yl]-5-(2,5-dimethylphenyl)-1,2-oxazole-3-carboxamide Traditional Name: 5-(2,5-dimethylphenyl)-N-[2-methyl-1-(piperonylcarbamoyl)propyl]isoxazole-3-carboxamide Formula: C25H27N3O5 MolecularWeight: 449.49898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=CC(=NO2)C(=O)NC(C(C)C)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=CC(=NO2)C(=O)NC(C(C)C)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H27N3O5/c1-14(2)23(25(30)26-12-17-7-8-20-22(10-17)32-13-31-20)27-24(29)19-11-21(33-28-19)18-9-15(3)5-6-16(18)4/h5-11,14,23H,12-13H2,1-4H3,(H,26,30)(H,27,29)