1-[3-(azepan-1-ylsulfonyl)phenyl]-N-methyl-ethanamine

Systemtic Name: 1-[3-(azepan-1-ylsulfonyl)phenyl]-N-methyl-ethanamine Openeye Name: 1-[3-(azepan-1-ylsulfonyl)phenyl]-N-methyl-ethanamine CAS Name: 1-[3-(1-azepanylsulfonyl)phenyl]-N-methylethanamine IUPAC Name: 1-[3-(azepan-1-ylsulfonyl)phenyl]-N-methylethanamine Traditional Name: 1-[3-(azepan-1-ylsulfonyl)phenyl]ethyl-methyl-amine Formula: C15H24N2O2S MolecularWeight: 296.42826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)NC

Isomeric SMILES

CC(C1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)NC

InChI

InChI=1S/C15H24N2O2S/c1-13(16-2)14-8-7-9-15(12-14)20(18,19)17-10-5-3-4-6-11-17/h7-9,12-13,16H,3-6,10-11H2,1-2H3