3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfamoyl)-4-methoxy-benzoic acid

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfamoyl)-4-methoxy-benzoic acid Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfamoyl)-4-methoxy-benzoic acid CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfamoyl)-4-methoxybenzoic acid IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfamoyl)-4-methoxybenzoic acid Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfamoyl)-4-methoxy-benzoic acid Formula: C17H17NO7S MolecularWeight: 379.38438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C17H17NO7S/c1-23-14-5-3-11(17(19)20)9-16(14)26(21,22)18-12-4-6-13-15(10-12)25-8-2-7-24-13/h3-6,9-10,18H,2,7-8H2,1H3,(H,19,20)