3-[(4-azanyl-2-methylsulfanyl-5-nitro-phenyl)amino]propane-1,1-diol

Systemtic Name: 3-[(4-azanyl-2-methylsulfanyl-5-nitro-phenyl)amino]propane-1,1-diol Openeye Name: 3-(4-amino-2-methylsulfanyl-5-nitro-anilino)propane-1,1-diol CAS Name: 3-[4-amino-2-(methylthio)-5-nitroanilino]propane-1,1-diol IUPAC Name: 3-(4-amino-2-methylsulfanyl-5-nitroanilino)propane-1,1-diol Traditional Name: 3-[4-amino-2-(methylthio)-5-nitro-anilino]propane-1,1-diol Formula: C10H15N3O4S MolecularWeight: 273.3088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1NCCC(O)O)[N+](=O)[O-])N

Isomeric SMILES

CSC1=CC(=C(C=C1NCCC(O)O)[N+](=O)[O-])N

InChI

InChI=1S/C10H15N3O4S/c1-18-9-4-6(11)8(13(16)17)5-7(9)12-3-2-10(14)15/h4-5,10,12,14-15H,2-3,11H2,1H3