2-[2-methyl-2-(4-nitrophenyl)sulfanyloxy-propyl]oxirane

Systemtic Name: 2-[2-methyl-2-(4-nitrophenyl)sulfanyloxy-propyl]oxirane Openeye Name: 2-[2-methyl-2-(4-nitrophenyl)sulfanyloxy-propyl]oxirane CAS Name: 4-nitrobenzenesulfenic acid [2-methyl-1-(2-oxiranyl)propan-2-yl] ester IUPAC Name: 2-[2-methyl-2-(4-nitrophenyl)sulfanyloxypropyl]oxirane Traditional Name: 2-[2-methyl-2-[(4-nitrophenyl)thio]oxy-propyl]oxirane Formula: C12H15NO4S MolecularWeight: 269.3168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1CO1)OSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CC1CO1)OSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H15NO4S/c1-12(2,7-10-8-16-10)17-18-11-5-3-9(4-6-11)13(14)15/h3-6,10H,7-8H2,1-2H3