(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-fluoranyl-ethanamine

Systemtic Name: (1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-fluoranyl-ethanamine Openeye Name: (1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-fluoro-ethanamine CAS Name: (1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-fluoroethanamine IUPAC Name: (1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-fluoroethanamine Traditional Name: [(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-fluoro-ethyl]amine Formula: C11H14FNO2 MolecularWeight: 211.232763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(CF)N)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)[C@@H](CF)N)OC1

InChI

InChI=1S/C11H14FNO2/c12-7-9(13)8-2-3-10-11(6-8)15-5-1-4-14-10/h2-3,6,9H,1,4-5,7,13H2/t9-/m1/s1