3-nitro-N-[2,2,2-tris(chloranyl)-1-diethoxyphosphoryl-ethyl]benzamide

Systemtic Name: 3-nitro-N-[2,2,2-tris(chloranyl)-1-diethoxyphosphoryl-ethyl]benzamide Openeye Name: 3-nitro-N-(2,2,2-trichloro-1-diethoxyphosphoryl-ethyl)benzamide CAS Name: 3-nitro-N-(2,2,2-trichloro-1-diethoxyphosphorylethyl)benzamide IUPAC Name: 3-nitro-N-(2,2,2-trichloro-1-diethoxyphosphorylethyl)benzamide Traditional Name: 3-nitro-N-(2,2,2-trichloro-1-diethoxyphosphoryl-ethyl)benzamide Formula: C13H16Cl3N2O6P MolecularWeight: 433.608701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C(Cl)(Cl)Cl)NC(=O)C1=CC(=CC=C1)[N+](=O)[O-])OCC

Isomeric SMILES

CCOP(=O)(C(C(Cl)(Cl)Cl)NC(=O)C1=CC(=CC=C1)[N+](=O)[O-])OCC

InChI

InChI=1S/C13H16Cl3N2O6P/c1-3-23-25(22,24-4-2)12(13(14,15)16)17-11(19)9-6-5-7-10(8-9)18(20)21/h5-8,12H,3-4H2,1-2H3,(H,17,19)