4-chloranyl-3-(6-methoxypyridin-3-yl)azanidylsulfonyl-benzoate

Systemtic Name: 4-chloranyl-3-(6-methoxypyridin-3-yl)azanidylsulfonyl-benzoate Openeye Name: 4-chloro-3-[(6-methoxy-3-pyridyl)azanidylsulfonyl]benzoate CAS Name: 4-chloro-3-[(6-methoxy-3-pyridinyl)azanidylsulfonyl]benzoate IUPAC Name: 4-chloro-3-(6-methoxypyridin-3-yl)azanidylsulfonylbenzoate Traditional Name: 4-chloro-3-[(6-methoxy-3-pyridyl)azanidylsulfonyl]benzoate Formula: C13H9ClN2O5S-2 MolecularWeight: 340.73896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)[N-]S(=O)(=O)C2=C(C=CC(=C2)C(=O)[O-])Cl

Isomeric SMILES

COC1=NC=C(C=C1)[N-]S(=O)(=O)C2=C(C=CC(=C2)C(=O)[O-])Cl

InChI

InChI=1S/C13H10ClN2O5S/c1-21-12-5-3-9(7-15-12)16-22(19,20)11-6-8(13(17)18)2-4-10(11)14/h2-7H,1H3,(H,17,18)/q-1/p-1