3-bromanyl-1,1,1-tris(chloranyl)-4-isocyanato-butane

Systemtic Name: 3-bromanyl-1,1,1-tris(chloranyl)-4-isocyanato-butane Openeye Name: 3-bromo-1,1,1-trichloro-4-isocyanato-butane CAS Name: 3-bromo-1,1,1-trichloro-4-isocyanatobutane IUPAC Name: 3-bromo-1,1,1-trichloro-4-isocyanatobutane Traditional Name: 3-bromo-1,1,1-trichloro-4-isocyanato-butane Formula: C5H5BrCl3NO MolecularWeight: 281.3623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C(CN=C=O)Br)C(Cl)(Cl)Cl

Isomeric SMILES

C(C(CN=C=O)Br)C(Cl)(Cl)Cl

InChI

InChI=1S/C5H5BrCl3NO/c6-4(2-10-3-11)1-5(7,8)9/h4H,1-2H2