1-[(3-fluorophenyl)methyl]-1,4-diazepane dihydrochloride

Systemtic Name: 1-[(3-fluorophenyl)methyl]-1,4-diazepane dihydrochloride Openeye Name: 1-[(3-fluorophenyl)methyl]-1,4-diazepane dihydrochloride CAS Name: 1-[(3-fluorophenyl)methyl]-1,4-diazepane dihydrochloride IUPAC Name: 1-[(3-fluorophenyl)methyl]-1,4-diazepane dihydrochloride Traditional Name: 1-(3-fluorobenzyl)-1,4-diazepane dihydrochloride Formula: C12H19Cl2FN2 MolecularWeight: 281.197063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)CC2=CC(=CC=C2)F.Cl.Cl

Isomeric SMILES

C1CNCCN(C1)CC2=CC(=CC=C2)F.Cl.Cl

InChI

InChI=1S/C12H17FN2.2ClH/c13-12-4-1-3-11(9-12)10-15-7-2-5-14-6-8-15;;/h1,3-4,9,14H,2,5-8,10H2;2*1H