5-(1,3-benzodioxol-5-ylmethylsulfamoyl)-2-methoxy-benzoic acid

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethylsulfamoyl)-2-methoxy-benzoic acid Openeye Name: 5-(1,3-benzodioxol-5-ylmethylsulfamoyl)-2-methoxy-benzoic acid CAS Name: 5-(1,3-benzodioxol-5-ylmethylsulfamoyl)-2-methoxybenzoic acid IUPAC Name: 5-(1,3-benzodioxol-5-ylmethylsulfamoyl)-2-methoxybenzoic acid Traditional Name: 2-methoxy-5-(piperonylsulfamoyl)benzoic acid Formula: C16H15NO7S MolecularWeight: 365.3578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)O

InChI

InChI=1S/C16H15NO7S/c1-22-13-5-3-11(7-12(13)16(18)19)25(20,21)17-8-10-2-4-14-15(6-10)24-9-23-14/h2-7,17H,8-9H2,1H3,(H,18,19)