[5-(cyanomethoxy)-3-ethynyl-2-nitro-phenyl]carbamic acid

Systemtic Name: [5-(cyanomethoxy)-3-ethynyl-2-nitro-phenyl]carbamic acid Openeye Name: [5-(cyanomethoxy)-3-ethynyl-2-nitro-phenyl]carbamic acid CAS Name: [5-(cyanomethoxy)-3-ethynyl-2-nitrophenyl]carbamic acid IUPAC Name: [5-(cyanomethoxy)-3-ethynyl-2-nitrophenyl]carbamic acid Traditional Name: [5-(cyanomethoxy)-3-ethynyl-2-nitro-phenyl]carbamic acid Formula: C11H7N3O5 MolecularWeight: 261.19038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC(=C1[N+](=O)[O-])NC(=O)O)OCC#N

Isomeric SMILES

C#CC1=CC(=CC(=C1[N+](=O)[O-])NC(=O)O)OCC#N

InChI

InChI=1S/C11H7N3O5/c1-2-7-5-8(19-4-3-12)6-9(13-11(15)16)10(7)14(17)18/h1,5-6,13H,4H2,(H,15,16)