1-(4-nitrophenyl)sulfanyladamantane

Systemtic Name: 1-(4-nitrophenyl)sulfanyladamantane Openeye Name: 1-(4-nitrophenyl)sulfanyladamantane CAS Name: 1-[(4-nitrophenyl)thio]adamantane IUPAC Name: 1-(4-nitrophenyl)sulfanyladamantane Traditional Name: 1-[(4-nitrophenyl)thio]adamantane Formula: C16H19NO2S MolecularWeight: 289.39256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)SC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)SC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H19NO2S/c18-17(19)14-1-3-15(4-2-14)20-16-8-11-5-12(9-16)7-13(6-11)10-16/h1-4,11-13H,5-10H2