6-chloranyl-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[4-(2-furylmethylsulfamoyl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-[4-(2-furanylmethylsulfamoyl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[4-(2-furfurylsulfamoyl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C21H19ClN2O6S MolecularWeight: 462.90336

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CO4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CO4)Cl)OC1

InChI

InChI=1S/C21H19ClN2O6S/c22-18-11-14(12-19-20(18)30-10-2-9-29-19)21(25)24-15-4-6-17(7-5-15)31(26,27)23-13-16-3-1-8-28-16/h1,3-8,11-12,23H,2,9-10,13H2,(H,24,25)