[5-(azepan-1-ylsulfonyl)-2-fluoranyl-phenyl]methanamine

Systemtic Name: [5-(azepan-1-ylsulfonyl)-2-fluoranyl-phenyl]methanamine Openeye Name: [5-(azepan-1-ylsulfonyl)-2-fluoro-phenyl]methanamine CAS Name: [5-(1-azepanylsulfonyl)-2-fluorophenyl]methanamine IUPAC Name: [5-(azepan-1-ylsulfonyl)-2-fluorophenyl]methanamine Traditional Name: [5-(azepan-1-ylsulfonyl)-2-fluoro-benzyl]amine Formula: C13H19FN2O2S MolecularWeight: 286.365563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)CN

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)CN

InChI

InChI=1S/C13H19FN2O2S/c14-13-6-5-12(9-11(13)10-15)19(17,18)16-7-3-1-2-4-8-16/h5-6,9H,1-4,7-8,10,15H2