N-(4-methyl-3,5-dinitro-phenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide

Systemtic Name: N-(4-methyl-3,5-dinitro-phenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide Openeye Name: 5-[(4-isopropylphenoxy)methyl]-N-(4-methyl-3,5-dinitro-phenyl)furan-2-carboxamide CAS Name: N-(4-methyl-3,5-dinitrophenyl)-5-[(4-propan-2-ylphenoxy)methyl]-2-furancarboxamide IUPAC Name: N-(4-methyl-3,5-dinitrophenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide Traditional Name: 5-[(4-isopropylphenoxy)methyl]-N-(4-methyl-3,5-dinitro-phenyl)-2-furamide Formula: C22H21N3O7 MolecularWeight: 439.41804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=CC=C(O2)COC3=CC=C(C=C3)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=CC=C(O2)COC3=CC=C(C=C3)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O7/c1-13(2)15-4-6-17(7-5-15)31-12-18-8-9-21(32-18)22(26)23-16-10-19(24(27)28)14(3)20(11-16)25(29)30/h4-11,13H,12H2,1-3H3,(H,23,26)