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

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[(3,4-diethoxyphenyl)methyl]furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[(3,4-diethoxyphenyl)methyl]furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-[(3,4-diethoxyphenyl)methyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-[(3,4-diethoxyphenyl)methyl]furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(3,4-diethoxybenzyl)-2-furamide Formula: C20H21BrN4O6 MolecularWeight: 493.30794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br)OCC

InChI

InChI=1S/C20H21BrN4O6/c1-3-29-16-7-5-13(9-18(16)30-4-2)10-22-20(26)17-8-6-14(31-17)11-24-12-15(21)19(23-24)25(27)28/h5-9,12H,3-4,10-11H2,1-2H3,(H,22,26)