6-azanyl-2-[(3-nitropyridin-2-yl)sulfanylamino]hexanoic acid

Systemtic Name: 6-azanyl-2-[(3-nitropyridin-2-yl)sulfanylamino]hexanoic acid Openeye Name: 6-amino-2-[(3-nitro-2-pyridyl)sulfanylamino]hexanoic acid CAS Name: 6-amino-2-[[(3-nitro-2-pyridinyl)thio]amino]hexanoic acid IUPAC Name: 6-amino-2-[(3-nitropyridin-2-yl)sulfanylamino]hexanoic acid Traditional Name: 6-amino-2-[[(3-nitro-2-pyridyl)thio]amino]hexanoic acid Formula: C11H16N4O4S MolecularWeight: 300.33414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SNC(CCCCN)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)SNC(CCCCN)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H16N4O4S/c12-6-2-1-4-8(11(16)17)14-20-10-9(15(18)19)5-3-7-13-10/h3,5,7-8,14H,1-2,4,6,12H2,(H,16,17)