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

Systemtic Name: (3-bromanyl-5-fluoranyl-phenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanamine Openeye Name: (3-bromo-5-fluoro-phenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanamine CAS Name: (3-bromo-5-fluorophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanamine IUPAC Name: (3-bromo-5-fluorophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanamine Traditional Name: [(3-bromo-5-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=CC(=CC(=C3)Br)F)N)OC1

Isomeric SMILES

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

InChI

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