N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[[5-(4-fluorophenyl)-2-furyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[[5-(4-fluorophenyl)-2-furanyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[[5-(4-fluorophenyl)-2-furyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C20H18FNO5S MolecularWeight: 403.424023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NCC3=CC=C(O3)C4=CC=C(C=C4)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NCC3=CC=C(O3)C4=CC=C(C=C4)F)OC1

InChI

InChI=1S/C20H18FNO5S/c21-15-4-2-14(3-5-15)18-8-6-16(27-18)13-22-28(23,24)17-7-9-19-20(12-17)26-11-1-10-25-19/h2-9,12,22H,1,10-11,13H2