N-(5-nitro-2-oxidanyl-phenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide

Systemtic Name: N-(5-nitro-2-oxidanyl-phenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide Openeye Name: N-(2-hydroxy-5-nitro-phenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide CAS Name: N-(2-hydroxy-5-nitrophenyl)-5-[(4-propylphenoxy)methyl]-2-furancarboxamide IUPAC Name: N-(2-hydroxy-5-nitrophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-phenyl)-5-[(4-propylphenoxy)methyl]-2-furamide Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

CCCC1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C21H20N2O6/c1-2-3-14-4-7-16(8-5-14)28-13-17-9-11-20(29-17)21(25)22-18-12-15(23(26)27)6-10-19(18)24/h4-12,24H,2-3,13H2,1H3,(H,22,25)