2-(3-oxidanidyl-3-oxidanylidene-propyl)sulfanylpyridine-3-carboxylate

Systemtic Name: 2-(3-oxidanidyl-3-oxidanylidene-propyl)sulfanylpyridine-3-carboxylate Openeye Name: 2-(3-oxido-3-oxo-propyl)sulfanylpyridine-3-carboxylate CAS Name: 2-[(3-oxido-3-oxopropyl)thio]-3-pyridinecarboxylate IUPAC Name: 2-(3-oxido-3-oxopropyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[(3-keto-3-oxido-propyl)thio]nicotinate Formula: C9H7NO4S-2 MolecularWeight: 225.22118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)SCCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C9H9NO4S/c11-7(12)3-5-15-8-6(9(13)14)2-1-4-10-8/h1-2,4H,3,5H2,(H,11,12)(H,13,14)/p-2