(5-bromanyl-2-fluoranyl-phenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanamine

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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