[5-(cyanomethyl)-4-iodanyl-2-nitro-phenyl]carbamic acid

Systemtic Name: [5-(cyanomethyl)-4-iodanyl-2-nitro-phenyl]carbamic acid Openeye Name: [5-(cyanomethyl)-4-iodo-2-nitro-phenyl]carbamic acid CAS Name: [5-(cyanomethyl)-4-iodo-2-nitrophenyl]carbamic acid IUPAC Name: [5-(cyanomethyl)-4-iodo-2-nitrophenyl]carbamic acid Traditional Name: [5-(cyanomethyl)-4-iodo-2-nitro-phenyl]carbamic acid Formula: C9H6IN3O4 MolecularWeight: 347.06611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1NC(=O)O)[N+](=O)[O-])I)CC#N

Isomeric SMILES

C1=C(C(=CC(=C1NC(=O)O)[N+](=O)[O-])I)CC#N

InChI

InChI=1S/C9H6IN3O4/c10-6-4-8(13(16)17)7(12-9(14)15)3-5(6)1-2-11/h3-4,12H,1H2,(H,14,15)