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

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[4-(3,4-diethoxybenzyl)oxyphenyl]-2-furamide Formula: C26H25BrN4O7 MolecularWeight: 585.4033

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)COC2=CC=C(C=C2)NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)COC2=CC=C(C=C2)NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br)OCC

InChI

InChI=1S/C26H25BrN4O7/c1-3-35-22-11-5-17(13-24(22)36-4-2)16-37-19-8-6-18(7-9-19)28-26(32)23-12-10-20(38-23)14-30-15-21(27)25(29-30)31(33)34/h5-13,15H,3-4,14,16H2,1-2H3,(H,28,32)