methyl 2-[[5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]furan-2-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]furan-2-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]furan-2-carbonyl]amino]acetate CAS Name: 2-[[[5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-2-furanyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[5-[(4-bromo-3-nitropyrazol-1-yl)methyl]furan-2-carbonyl]amino]acetate Traditional Name: 2-[[5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-2-furoyl]amino]acetic acid methyl ester Formula: C12H11BrN4O6 MolecularWeight: 387.14294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11BrN4O6/c1-22-10(18)4-14-12(19)9-3-2-7(23-9)5-16-6-8(13)11(15-16)17(20)21/h2-3,6H,4-5H2,1H3,(H,14,19)