N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine

Systemtic Name: N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Openeye Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine CAS Name: N-[(5-bromo-2-fluorophenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine IUPAC Name: N-[(5-bromo-2-fluorophenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Traditional Name: (5-bromo-2-fluoro-benzyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)amine Formula: C16H15BrFNO2 MolecularWeight: 352.198203

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NCC3=C(C=CC(=C3)Br)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NCC3=C(C=CC(=C3)Br)F)OC1

InChI

InChI=1S/C16H15BrFNO2/c17-12-2-4-14(18)11(8-12)10-19-13-3-5-15-16(9-13)21-7-1-6-20-15/h2-5,8-9,19H,1,6-7,10H2