3-[[[(2S)-2-(4-fluoranylphenoxy)propanoyl]amino]sulfamoyl]-4,5-dimethyl-benzoate

Systemtic Name: 3-[[[(2S)-2-(4-fluoranylphenoxy)propanoyl]amino]sulfamoyl]-4,5-dimethyl-benzoate Openeye Name: 3-[[[(2S)-2-(4-fluorophenoxy)propanoyl]amino]sulfamoyl]-4,5-dimethyl-benzoate CAS Name: 3-[[[(2S)-2-(4-fluorophenoxy)-1-oxopropyl]amino]sulfamoyl]-4,5-dimethylbenzoate IUPAC Name: 3-[[[(2S)-2-(4-fluorophenoxy)propanoyl]amino]sulfamoyl]-4,5-dimethylbenzoate Traditional Name: 3-[[[(2S)-2-(4-fluorophenoxy)propanoyl]amino]sulfamoyl]-4,5-dimethyl-benzoate Formula: C18H18FN2O6S- MolecularWeight: 409.408723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)NNC(=O)C(C)OC2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)NNC(=O)[C@H](C)OC2=CC=C(C=C2)F)C

InChI

InChI=1S/C18H19FN2O6S/c1-10-8-13(18(23)24)9-16(11(10)2)28(25,26)21-20-17(22)12(3)27-15-6-4-14(19)5-7-15/h4-9,12,21H,1-3H3,(H,20,22)(H,23,24)/p-1/t12-/m0/s1