1-[2-(chloromethyl)-4-fluoranyl-phenyl]-4-methyl-1,4-diazepane

Systemtic Name: 1-[2-(chloromethyl)-4-fluoranyl-phenyl]-4-methyl-1,4-diazepane Openeye Name: 1-[2-(chloromethyl)-4-fluoro-phenyl]-4-methyl-1,4-diazepane CAS Name: 1-[2-(chloromethyl)-4-fluorophenyl]-4-methyl-1,4-diazepane IUPAC Name: 1-[2-(chloromethyl)-4-fluorophenyl]-4-methyl-1,4-diazepane Traditional Name: 1-[2-(chloromethyl)-4-fluoro-phenyl]-4-methyl-1,4-diazepane Formula: C13H18ClFN2 MolecularWeight: 256.746823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=C(C=C(C=C2)F)CCl

Isomeric SMILES

CN1CCCN(CC1)C2=C(C=C(C=C2)F)CCl

InChI

InChI=1S/C13H18ClFN2/c1-16-5-2-6-17(8-7-16)13-4-3-12(15)9-11(13)10-14/h3-4,9H,2,5-8,10H2,1H3