4-[2-(4-nitrophenyl)sulfanylethoxy]benzoate

Systemtic Name: 4-[2-(4-nitrophenyl)sulfanylethoxy]benzoate Openeye Name: 4-[2-(4-nitrophenyl)sulfanylethoxy]benzoate CAS Name: 4-[2-[(4-nitrophenyl)thio]ethoxy]benzoate IUPAC Name: 4-[2-(4-nitrophenyl)sulfanylethoxy]benzoate Traditional Name: 4-[2-[(4-nitrophenyl)thio]ethoxy]benzoate Formula: C15H12NO5S- MolecularWeight: 318.32448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])OCCSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])OCCSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H13NO5S/c17-15(18)11-1-5-13(6-2-11)21-9-10-22-14-7-3-12(4-8-14)16(19)20/h1-8H,9-10H2,(H,17,18)/p-1