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

Systemtic Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-5-[(4-methyl-2-nitro-phenoxy)methyl]furan-2-carboxamide Openeye Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-5-[(4-methyl-2-nitro-phenoxy)methyl]furan-2-carboxamide CAS Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-5-[(4-methyl-2-nitrophenoxy)methyl]-2-furancarboxamide IUPAC Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-5-[(4-methyl-2-nitrophenoxy)methyl]furan-2-carboxamide Traditional Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-5-[(4-methyl-2-nitro-phenoxy)methyl]-2-furamide Formula: C27H23N3O8 MolecularWeight: 517.48682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=CC(=CC(=C3)OC4=CC(=CC(=C4)C)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=CC(=CC(=C3)OC4=CC(=CC(=C4)C)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C27H23N3O8/c1-16-4-6-25(24(11-16)30(34)35)36-15-21-5-7-26(38-21)27(31)28-19-12-20(29(32)33)14-23(13-19)37-22-9-17(2)8-18(3)10-22/h4-14H,15H2,1-3H3,(H,28,31)