5-bromanyl-N-[3-[(E)-C-methyl-N-(nonanoylamino)carbonimidoyl]phenyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[3-[(E)-C-methyl-N-(nonanoylamino)carbonimidoyl]phenyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[3-[(E)-C-methyl-N-(nonanoylamino)carbonimidoyl]phenyl]furan-2-carboxamide CAS Name: 5-bromo-N-[3-[(1E)-1-(1-oxononylhydrazinylidene)ethyl]phenyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[3-[(E)-C-methyl-N-(nonanoylamino)carbonimidoyl]phenyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[3-[(E)-C-methyl-N-(pelargonylamino)carbonimidoyl]phenyl]-2-furamide Formula: C22H28BrN3O3 MolecularWeight: 462.38002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NN=C(C)C1=CC(=CC=C1)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

CCCCCCCCC(=O)N/N=C(\C)/C1=CC(=CC=C1)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C22H28BrN3O3/c1-3-4-5-6-7-8-12-21(27)26-25-16(2)17-10-9-11-18(15-17)24-22(28)19-13-14-20(23)29-19/h9-11,13-15H,3-8,12H2,1-2H3,(H,24,28)(H,26,27)/b25-16+