(4-nitrophenyl)methyl N-(1-sulfanylpropyl)carbamate

Systemtic Name: (4-nitrophenyl)methyl N-(1-sulfanylpropyl)carbamate Openeye Name: (4-nitrophenyl)methyl N-(1-sulfanylpropyl)carbamate CAS Name: N-(1-mercaptopropyl)carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-(1-sulfanylpropyl)carbamate Traditional Name: N-(1-mercaptopropyl)carbamic acid (4-nitrobenzyl) ester Formula: C11H14N2O4S MolecularWeight: 270.30486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O4S/c1-2-10(18)12-11(14)17-7-8-3-5-9(6-4-8)13(15)16/h3-6,10,18H,2,7H2,1H3,(H,12,14)