methyl 4-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]benzoate

Systemtic Name: methyl 4-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]benzoate Openeye Name: methyl 4-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]benzoate CAS Name: 4-[[2-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]benzoate Traditional Name: 4-[[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]sulfamoyl]benzoic acid methyl ester Formula: C22H18N2O7S MolecularWeight: 454.45252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N2O7S/c1-29-22(26)14-6-9-16(10-7-14)32(27,28)24-18-5-3-2-4-17(18)21(25)23-15-8-11-19-20(12-15)31-13-30-19/h2-12,24H,13H2,1H3,(H,23,25)