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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[3-cyclopentylpropanoyl-(phenylmethyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[benzyl(3-cyclopentylpropanoyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(3-cyclopentyl-1-oxopropyl)-(phenylmethyl)amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[benzyl(3-cyclopentylpropanoyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[benzyl(3-cyclopentylpropanoyl)amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N(CC2=CC=CC=C2)CC3=CC(=NO3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCC(C1)CCC(=O)N(CC2=CC=CC=C2)CC3=CC(=NO3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H31N3O5/c32-27(13-11-20-6-4-5-7-20)31(17-21-8-2-1-3-9-21)18-23-15-24(30-36-23)28(33)29-16-22-10-12-25-26(14-22)35-19-34-25/h1-3,8-10,12,14-15,20H,4-7,11,13,16-19H2,(H,29,33)