5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(2-methylpropyl)furan-2-carboxamide

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(2-methylpropyl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-isobutyl-furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-(2-methylpropyl)-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-(2-methylpropyl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-isobutyl-2-furamide Formula: C13H15BrN4O4 MolecularWeight: 371.1866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC=C(O1)CN2C=C(C(=N2)[N+](=O)[O-])Br

Isomeric SMILES

CC(C)CNC(=O)C1=CC=C(O1)CN2C=C(C(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C13H15BrN4O4/c1-8(2)5-15-13(19)11-4-3-9(22-11)6-17-7-10(14)12(16-17)18(20)21/h3-4,7-8H,5-6H2,1-2H3,(H,15,19)