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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[2-methylpropyl(3-phenylpropanoyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[isobutyl(3-phenylpropanoyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[2-methylpropyl-(1-oxo-3-phenylpropyl)amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[2-methylpropyl(3-phenylpropanoyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[hydrocinnamoyl(isobutyl)amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C26H29N3O5 MolecularWeight: 463.52556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)CN(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O5/c1-18(2)15-29(25(30)11-9-19-6-4-3-5-7-19)16-21-13-22(28-34-21)26(31)27-14-20-8-10-23-24(12-20)33-17-32-23/h3-8,10,12-13,18H,9,11,14-17H2,1-2H3,(H,27,31)