N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-(4-methylphenyl)carbonyl-amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-(4-methylphenyl)carbonyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(4-methylbenzoyl)-sec-butyl-amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-[(4-methylphenyl)-oxomethyl]amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-(4-methylbenzoyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-piperonyl-5-[[p-toluoyl(sec-butyl)amino]methyl]isoxazole-3-carboxamide Formula: C25H27N3O5 MolecularWeight: 449.49898

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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)C4=CC=C(C=C4)C

Isomeric SMILES

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

InChI

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