N-[1-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-4-fluoranyl-benzamide Openeye Name: N-[1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-4-fluoro-benzamide CAS Name: N-[1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-4-fluorobenzamide IUPAC Name: N-[1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-4-fluorobenzamide Traditional Name: N-[1-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethyl]-4-fluoro-benzamide Formula: C18H17BrFNO3 MolecularWeight: 394.234883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1Br)OCCCO2)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C1=CC2=C(C=C1Br)OCCCO2)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H17BrFNO3/c1-11(21-18(22)12-3-5-13(20)6-4-12)14-9-16-17(10-15(14)19)24-8-2-7-23-16/h3-6,9-11H,2,7-8H2,1H3,(H,21,22)