2-[2-[(3-oxidanidyl-3-oxidanylidene-propyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate

Systemtic Name: 2-[2-[(3-oxidanidyl-3-oxidanylidene-propyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate Openeye Name: 2-[2-[(3-oxido-3-oxo-propyl)amino]-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[2-[(3-oxido-3-oxopropyl)amino]-2-oxoethyl]thio]-3-pyridinecarboxylate IUPAC Name: 2-[2-[(3-oxido-3-oxopropyl)amino]-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[2-keto-2-[(3-keto-3-oxido-propyl)amino]ethyl]thio]nicotinate Formula: C11H10N2O5S-2 MolecularWeight: 282.2725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC(=O)NCCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)SCC(=O)NCCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C11H12N2O5S/c14-8(12-5-3-9(15)16)6-19-10-7(11(17)18)2-1-4-13-10/h1-2,4H,3,5-6H2,(H,12,14)(H,15,16)(H,17,18)/p-2