3-[2,4-bis(fluoranyl)phenyl]azanidylsulfonyl-4-chloranyl-benzoate

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]azanidylsulfonyl-4-chloranyl-benzoate Openeye Name: 4-chloro-3-(2,4-difluorophenyl)azanidylsulfonyl-benzoate CAS Name: 4-chloro-3-(2,4-difluorophenyl)azanidylsulfonylbenzoate IUPAC Name: 4-chloro-3-(2,4-difluorophenyl)azanidylsulfonylbenzoate Traditional Name: 4-chloro-3-(2,4-difluorophenyl)azanidylsulfonyl-benzoate Formula: C13H6ClF2NO4S-2 MolecularWeight: 345.705846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H7ClF2NO4S/c14-9-3-1-7(13(18)19)5-12(9)22(20,21)17-11-4-2-8(15)6-10(11)16/h1-6H,(H,18,19)/q-1/p-1