4-methyl-3-nitro-N-[3-nitro-5-[2,2,2-tris(fluoranyl)ethoxy]phenyl]benzamide

Systemtic Name: 4-methyl-3-nitro-N-[3-nitro-5-[2,2,2-tris(fluoranyl)ethoxy]phenyl]benzamide Openeye Name: 4-methyl-3-nitro-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide CAS Name: 4-methyl-3-nitro-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide IUPAC Name: 4-methyl-3-nitro-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide Traditional Name: 4-methyl-3-nitro-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide Formula: C16H12F3N3O6 MolecularWeight: 399.27819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC(=C2)OCC(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC(=C2)OCC(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12F3N3O6/c1-9-2-3-10(4-14(9)22(26)27)15(23)20-11-5-12(21(24)25)7-13(6-11)28-8-16(17,18)19/h2-7H,8H2,1H3,(H,20,23)