5-chloranyl-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-fluoranyl-benzamide

Systemtic Name: 5-chloranyl-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-fluoranyl-benzamide Openeye Name: 5-chloro-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-fluoro-benzamide CAS Name: 5-chloro-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-fluorobenzamide IUPAC Name: 5-chloro-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-fluorobenzamide Traditional Name: 5-chloro-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-fluoro-benzamide Formula: C22H18ClFN2O5S MolecularWeight: 476.905123

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)Cl)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)Cl)F)OC1

InChI

InChI=1S/C22H18ClFN2O5S/c23-14-2-8-19(24)18(12-14)22(27)25-15-3-5-16(6-4-15)26-32(28,29)17-7-9-20-21(13-17)31-11-1-10-30-20/h2-9,12-13,26H,1,10-11H2,(H,25,27)