N-(4-bromanyl-2-fluoranyl-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C16H13BrFNO3 MolecularWeight: 366.181723

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)F)OC1

InChI

InChI=1S/C16H13BrFNO3/c17-11-3-4-13(12(18)9-11)19-16(20)10-2-5-14-15(8-10)22-7-1-6-21-14/h2-5,8-9H,1,6-7H2,(H,19,20)