1-(isocyanomethylsulfonyl)-4-methyl-benzene

Systemtic Name: 1-(isocyanomethylsulfonyl)-4-methyl-benzene Openeye Name: 1-(isocyanomethylsulfonyl)-4-methyl-benzene CAS Name: 1-(isocyanomethylsulfonyl)-4-methylbenzene IUPAC Name: 1-(isocyanomethylsulfonyl)-4-methylbenzene Traditional Name: 1-(isocyanomethylsulfonyl)-4-methyl-benzene Formula: C9H9NO2S MolecularWeight: 195.23826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO2S/c1-8-3-5-9(6-4-8)13(11,12)7-10-2/h3-6H,7H2,1H3