3-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid

Systemtic Name: 3-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid Openeye Name: 3-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3-[[2-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenyl]sulfamoyl]-4,5-dimethylbenzoic acid IUPAC Name: 3-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]-4,5-dimethylbenzoic acid Traditional Name: 3-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C23H20N2O7S MolecularWeight: 468.4791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C23H20N2O7S/c1-13-9-15(23(27)28)10-21(14(13)2)33(29,30)25-18-6-4-3-5-17(18)22(26)24-16-7-8-19-20(11-16)32-12-31-19/h3-11,25H,12H2,1-2H3,(H,24,26)(H,27,28)