1-isocyanatosulfanyl-4-nitro-benzene

Systemtic Name: 1-isocyanatosulfanyl-4-nitro-benzene Openeye Name: 1-isocyanatosulfanyl-4-nitro-benzene CAS Name: 4-nitro-N-(oxomethylidene)benzenesulfenamide IUPAC Name: 1-isocyanatosulfanyl-4-nitrobenzene Traditional Name: 1-(isocyanatothio)-4-nitro-benzene Formula: C7H4N2O3S MolecularWeight: 196.18326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])SN=C=O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])SN=C=O

InChI

InChI=1S/C7H4N2O3S/c10-5-8-13-7-3-1-6(2-4-7)9(11)12/h1-4H