6-(1,3-benzoxazol-2-ylsulfanyl)-3-chloranyl-pyridine-2-carboxylate

Systemtic Name: 6-(1,3-benzoxazol-2-ylsulfanyl)-3-chloranyl-pyridine-2-carboxylate Openeye Name: 6-(1,3-benzoxazol-2-ylsulfanyl)-3-chloro-pyridine-2-carboxylate CAS Name: 6-(1,3-benzoxazol-2-ylthio)-3-chloro-2-pyridinecarboxylate IUPAC Name: 6-(1,3-benzoxazol-2-ylsulfanyl)-3-chloropyridine-2-carboxylate Traditional Name: 6-(1,3-benzoxazol-2-ylthio)-3-chloro-picolinate Formula: C13H6ClN2O3S- MolecularWeight: 305.71634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SC3=NC(=C(C=C3)Cl)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SC3=NC(=C(C=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C13H7ClN2O3S/c14-7-5-6-10(16-11(7)12(17)18)20-13-15-8-3-1-2-4-9(8)19-13/h1-6H,(H,17,18)/p-1