[(1S)-1-[2-(azepan-1-ylsulfonylamino)phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-(azepan-1-ylsulfonylamino)phenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-(azepan-1-ylsulfonylamino)phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-(1-azepanylsulfonylamino)phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-(azepan-1-ylsulfonylamino)phenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-(azepan-1-ylsulfonylamino)phenyl]ethyl]ammonium Formula: C14H24N3O2S+ MolecularWeight: 298.42426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1NS(=O)(=O)N2CCCCCC2)[NH3+]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1NS(=O)(=O)N2CCCCCC2)[NH3+]

InChI

InChI=1S/C14H23N3O2S/c1-12(15)13-8-4-5-9-14(13)16-20(18,19)17-10-6-2-3-7-11-17/h4-5,8-9,12,16H,2-3,6-7,10-11,15H2,1H3/p+1/t12-/m0/s1