(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 5-(cyclopropylsulfamoyl)furan-2-carboxylate

Systemtic Name: (6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 5-(cyclopropylsulfamoyl)furan-2-carboxylate Openeye Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 5-(cyclopropylsulfamoyl)furan-2-carboxylate CAS Name: 5-(cyclopropylsulfamoyl)-2-furancarboxylic acid (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl ester IUPAC Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 5-(cyclopropylsulfamoyl)furan-2-carboxylate Traditional Name: 5-(cyclopropylsulfamoyl)furan-2-carboxylic acid (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl ester Formula: C18H18ClNO7S MolecularWeight: 427.85602

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)COC(=O)C3=CC=C(O3)S(=O)(=O)NC4CC4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)COC(=O)C3=CC=C(O3)S(=O)(=O)NC4CC4)Cl)OC1

InChI

InChI=1S/C18H18ClNO7S/c19-13-8-11(9-15-17(13)25-7-1-6-24-15)10-26-18(21)14-4-5-16(27-14)28(22,23)20-12-2-3-12/h4-5,8-9,12,20H,1-3,6-7,10H2