2-(azepan-1-ylmethyl)-6-bromanyl-4-fluoranyl-aniline

Systemtic Name: 2-(azepan-1-ylmethyl)-6-bromanyl-4-fluoranyl-aniline Openeye Name: 2-(azepan-1-ylmethyl)-6-bromo-4-fluoro-aniline CAS Name: 2-(1-azepanylmethyl)-6-bromo-4-fluoroaniline IUPAC Name: 2-(azepan-1-ylmethyl)-6-bromo-4-fluoroaniline Traditional Name: [2-(azepan-1-ylmethyl)-6-bromo-4-fluoro-phenyl]amine Formula: C13H18BrFN2 MolecularWeight: 301.197823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC(=CC(=C2N)Br)F

Isomeric SMILES

C1CCCN(CC1)CC2=CC(=CC(=C2N)Br)F

InChI

InChI=1S/C13H18BrFN2/c14-12-8-11(15)7-10(13(12)16)9-17-5-3-1-2-4-6-17/h7-8H,1-6,9,16H2