5-bromanyl-2-isocyanato-1,3-dimethyl-benzene

Systemtic Name: 5-bromanyl-2-isocyanato-1,3-dimethyl-benzene Openeye Name: 5-bromo-2-isocyanato-1,3-dimethyl-benzene CAS Name: 5-bromo-2-isocyanato-1,3-dimethylbenzene IUPAC Name: 5-bromo-2-isocyanato-1,3-dimethylbenzene Traditional Name: 5-bromo-2-isocyanato-1,3-dimethyl-benzene Formula: C9H8BrNO MolecularWeight: 226.06992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1N=C=O)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1N=C=O)C)Br

InChI

InChI=1S/C9H8BrNO/c1-6-3-8(10)4-7(2)9(6)11-5-12/h3-4H,1-2H3