3-(5-bromanylpyridin-2-yl)azanidylsulfonyl-4-chloranyl-benzoate

Systemtic Name: 3-(5-bromanylpyridin-2-yl)azanidylsulfonyl-4-chloranyl-benzoate Openeye Name: 3-[(5-bromo-2-pyridyl)azanidylsulfonyl]-4-chloro-benzoate CAS Name: 3-[(5-bromo-2-pyridinyl)azanidylsulfonyl]-4-chlorobenzoate IUPAC Name: 3-(5-bromopyridin-2-yl)azanidylsulfonyl-4-chlorobenzoate Traditional Name: 3-[(5-bromo-2-pyridyl)azanidylsulfonyl]-4-chloro-benzoate Formula: C12H6BrClN2O4S-2 MolecularWeight: 389.60904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)[O-])S(=O)(=O)[N-]C2=NC=C(C=C2)Br)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)[O-])S(=O)(=O)[N-]C2=NC=C(C=C2)Br)Cl

InChI

InChI=1S/C12H8BrClN2O4S/c13-8-2-4-11(15-6-8)16-21(19,20)10-5-7(12(17)18)1-3-9(10)14/h1-6H,(H2,15,16,17,18)/p-2