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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[phenethyl(phenylcarbonyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[benzoyl(phenethyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[benzoyl(phenethyl)amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[benzoyl(phenethyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[benzoyl(phenethyl)amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C28H25N3O5 MolecularWeight: 483.5152

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=NOC(=C3)CN(CCC4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=NOC(=C3)CN(CCC4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H25N3O5/c32-27(29-17-21-11-12-25-26(15-21)35-19-34-25)24-16-23(36-30-24)18-31(14-13-20-7-3-1-4-8-20)28(33)22-9-5-2-6-10-22/h1-12,15-16H,13-14,17-19H2,(H,29,32)