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

Systemtic Name: 3-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]-4-methoxy-benzoic acid Openeye Name: 3-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]-4-methoxy-benzoic acid CAS Name: 3-[[2-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenyl]sulfamoyl]-4-methoxybenzoic acid IUPAC Name: 3-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]-4-methoxybenzoic acid Traditional Name: 3-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]-4-methoxy-benzoic acid Formula: C22H18N2O8S MolecularWeight: 470.45192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H18N2O8S/c1-30-18-8-6-13(22(26)27)10-20(18)33(28,29)24-16-5-3-2-4-15(16)21(25)23-14-7-9-17-19(11-14)32-12-31-17/h2-11,24H,12H2,1H3,(H,23,25)(H,26,27)