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

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[3-(diethylamino)propyl]furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[3-(diethylamino)propyl]furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-[3-(diethylamino)propyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-[3-(diethylamino)propyl]furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[3-(diethylamino)propyl]-2-furamide Formula: C16H22BrN5O4 MolecularWeight: 428.28098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22BrN5O4/c1-3-20(4-2)9-5-8-18-16(23)14-7-6-12(26-14)10-21-11-13(17)15(19-21)22(24)25/h6-7,11H,3-5,8-10H2,1-2H3,(H,18,23)