N-(1,3-benzodioxol-5-ylmethyl)-5-[[(2-bromophenyl)carbonyl-cyclopropyl-amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(2-bromophenyl)carbonyl-cyclopropyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(2-bromobenzoyl)-cyclopropyl-amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[[(2-bromophenyl)-oxomethyl]-cyclopropylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(2-bromobenzoyl)-cyclopropylamino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[(2-bromobenzoyl)-cyclopropyl-amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C23H20BrN3O5 MolecularWeight: 498.326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC(=NO2)C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)C5=CC=CC=C5Br

Isomeric SMILES

C1CC1N(CC2=CC(=NO2)C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)C5=CC=CC=C5Br

InChI

InChI=1S/C23H20BrN3O5/c24-18-4-2-1-3-17(18)23(29)27(15-6-7-15)12-16-10-19(26-32-16)22(28)25-11-14-5-8-20-21(9-14)31-13-30-20/h1-5,8-10,15H,6-7,11-13H2,(H,25,28)