N-(2-cyano-4-nitro-phenyl)-5-[(3,5-dimethylphenoxy)methyl]furan-2-carboxamide

Systemtic Name: N-(2-cyano-4-nitro-phenyl)-5-[(3,5-dimethylphenoxy)methyl]furan-2-carboxamide Openeye Name: N-(2-cyano-4-nitro-phenyl)-5-[(3,5-dimethylphenoxy)methyl]furan-2-carboxamide CAS Name: N-(2-cyano-4-nitrophenyl)-5-[(3,5-dimethylphenoxy)methyl]-2-furancarboxamide IUPAC Name: N-(2-cyano-4-nitrophenyl)-5-[(3,5-dimethylphenoxy)methyl]furan-2-carboxamide Traditional Name: N-(2-cyano-4-nitro-phenyl)-5-[(3,5-dimethylphenoxy)methyl]-2-furamide Formula: C21H17N3O5 MolecularWeight: 391.37678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC2=CC=C(O2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2=CC=C(O2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N)C

InChI

InChI=1S/C21H17N3O5/c1-13-7-14(2)9-18(8-13)28-12-17-4-6-20(29-17)21(25)23-19-5-3-16(24(26)27)10-15(19)11-22/h3-10H,12H2,1-2H3,(H,23,25)