1-(2-dimethoxyphosphorylethynyl)-4-nitro-benzene

Systemtic Name: 1-(2-dimethoxyphosphorylethynyl)-4-nitro-benzene Openeye Name: 1-(2-dimethoxyphosphorylethynyl)-4-nitro-benzene CAS Name: 1-(2-dimethoxyphosphorylethynyl)-4-nitrobenzene IUPAC Name: 1-(2-dimethoxyphosphorylethynyl)-4-nitrobenzene Traditional Name: 1-(2-dimethoxyphosphorylethynyl)-4-nitro-benzene Formula: C10H10NO5P MolecularWeight: 255.163861

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C#CC1=CC=C(C=C1)[N+](=O)[O-])OC

Isomeric SMILES

COP(=O)(C#CC1=CC=C(C=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C10H10NO5P/c1-15-17(14,16-2)8-7-9-3-5-10(6-4-9)11(12)13/h3-6H,1-2H3