N-butyl-N-(5-nitrofuran-2-yl)-3-phenyl-pyrazole-1-carboxamide

Systemtic Name: N-butyl-N-(5-nitrofuran-2-yl)-3-phenyl-pyrazole-1-carboxamide Openeye Name: N-butyl-N-(5-nitro-2-furyl)-3-phenyl-pyrazole-1-carboxamide CAS Name: N-butyl-N-(5-nitro-2-furanyl)-3-phenyl-1-pyrazolecarboxamide IUPAC Name: N-butyl-N-(5-nitrofuran-2-yl)-3-phenylpyrazole-1-carboxamide Traditional Name: N-butyl-N-(5-nitro-2-furyl)-3-phenyl-pyrazole-1-carboxamide Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=C(O1)[N+](=O)[O-])C(=O)N2C=CC(=N2)C3=CC=CC=C3

Isomeric SMILES

CCCCN(C1=CC=C(O1)[N+](=O)[O-])C(=O)N2C=CC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H18N4O4/c1-2-3-12-20(16-9-10-17(26-16)22(24)25)18(23)21-13-11-15(19-21)14-7-5-4-6-8-14/h4-11,13H,2-3,12H2,1H3