(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-(cyclopropylsulfamoyl)-4-methoxy-benzoate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-(cyclopropylsulfamoyl)-4-methoxy-benzoate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-(cyclopropylsulfamoyl)-4-methoxy-benzoate CAS Name: 3-(cyclopropylsulfamoyl)-4-methoxybenzoic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-(cyclopropylsulfamoyl)-4-methoxybenzoate Traditional Name: 3-(cyclopropylsulfamoyl)-4-methoxy-benzoic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C20H20BrNO7S MolecularWeight: 498.3443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC2=CC3=C(C=C2Br)OCCO3)S(=O)(=O)NC4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC2=CC3=C(C=C2Br)OCCO3)S(=O)(=O)NC4CC4

InChI

InChI=1S/C20H20BrNO7S/c1-26-16-5-2-12(9-19(16)30(24,25)22-14-3-4-14)20(23)29-11-13-8-17-18(10-15(13)21)28-7-6-27-17/h2,5,8-10,14,22H,3-4,6-7,11H2,1H3