2-(4-nitrophenyl)-2-pentyl-1,3-dithiane

Systemtic Name: 2-(4-nitrophenyl)-2-pentyl-1,3-dithiane Openeye Name: 2-(4-nitrophenyl)-2-pentyl-1,3-dithiane CAS Name: 2-(4-nitrophenyl)-2-pentyl-1,3-dithiane IUPAC Name: 2-(4-nitrophenyl)-2-pentyl-1,3-dithiane Traditional Name: 2-amyl-2-(4-nitrophenyl)-1,3-dithiane Formula: C15H21NO2S2 MolecularWeight: 311.46274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(SCCCS1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1(SCCCS1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H21NO2S2/c1-2-3-4-10-15(19-11-5-12-20-15)13-6-8-14(9-7-13)16(17)18/h6-9H,2-5,10-12H2,1H3