6-chloranyl-8-[2-(2-nitrophenyl)sulfanylethyl]-4H-1,3-benzodioxine

Systemtic Name: 6-chloranyl-8-[2-(2-nitrophenyl)sulfanylethyl]-4H-1,3-benzodioxine Openeye Name: 6-chloro-8-[2-(2-nitrophenyl)sulfanylethyl]-4H-1,3-benzodioxine CAS Name: 6-chloro-8-[2-[(2-nitrophenyl)thio]ethyl]-4H-1,3-benzodioxin IUPAC Name: 6-chloro-8-[2-(2-nitrophenyl)sulfanylethyl]-4H-1,3-benzodioxine Traditional Name: 6-chloro-8-[2-[(2-nitrophenyl)thio]ethyl]-4H-1,3-benzodioxin Formula: C16H14ClNO4S MolecularWeight: 351.80466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CCSC3=CC=CC=C3[N+](=O)[O-])Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CCSC3=CC=CC=C3[N+](=O)[O-])Cl

InChI

InChI=1S/C16H14ClNO4S/c17-13-7-11(16-12(8-13)9-21-10-22-16)5-6-23-15-4-2-1-3-14(15)18(19)20/h1-4,7-8H,5-6,9-10H2