N-(4-methylsulfonyl-2-nitro-phenyl)oxan-4-amine

Systemtic Name: N-(4-methylsulfonyl-2-nitro-phenyl)oxan-4-amine Openeye Name: N-(4-methylsulfonyl-2-nitro-phenyl)tetrahydropyran-4-amine CAS Name: N-(4-methylsulfonyl-2-nitrophenyl)-4-oxanamine IUPAC Name: N-(4-methylsulfonyl-2-nitrophenyl)oxan-4-amine Traditional Name: (4-mesyl-2-nitro-phenyl)-tetrahydropyran-4-yl-amine Formula: C12H16N2O5S MolecularWeight: 300.33084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NC2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NC2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O5S/c1-20(17,18)10-2-3-11(12(8-10)14(15)16)13-9-4-6-19-7-5-9/h2-3,8-9,13H,4-7H2,1H3