(4-nitrophenyl)methyl N-(1-bromanylsulfanylpropan-2-yl)carbamate

Systemtic Name: (4-nitrophenyl)methyl N-(1-bromanylsulfanylpropan-2-yl)carbamate Openeye Name: (4-nitrophenyl)methyl N-(2-bromosulfanyl-1-methyl-ethyl)carbamate CAS Name: N-[1-(bromothio)propan-2-yl]carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-(1-bromosulfanylpropan-2-yl)carbamate Traditional Name: N-[2-(bromothio)-1-methyl-ethyl]carbamic acid (4-nitrobenzyl) ester Formula: C11H13BrN2O4S MolecularWeight: 349.20092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CSBr)NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(CSBr)NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H13BrN2O4S/c1-8(7-19-12)13-11(15)18-6-9-2-4-10(5-3-9)14(16)17/h2-5,8H,6-7H2,1H3,(H,13,15)