[(3R)-2-oxidanylideneazepan-3-yl]-(2-thiophen-2-ylethyl)azanium

Systemtic Name: [(3R)-2-oxidanylideneazepan-3-yl]-(2-thiophen-2-ylethyl)azanium Openeye Name: [(3R)-2-oxoazepan-3-yl]-[2-(2-thienyl)ethyl]ammonium CAS Name: [(3R)-2-oxo-3-azepanyl]-(2-thiophen-2-ylethyl)ammonium IUPAC Name: [(3R)-2-oxoazepan-3-yl]-(2-thiophen-2-ylethyl)azanium Traditional Name: [(3R)-2-ketoazepan-3-yl]-[2-(2-thienyl)ethyl]ammonium Formula: C12H19N2OS+ MolecularWeight: 239.35706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)[NH2+]CCC2=CC=CS2

Isomeric SMILES

C1CCNC(=O)[C@@H](C1)[NH2+]CCC2=CC=CS2

InChI

InChI=1S/C12H18N2OS/c15-12-11(5-1-2-7-14-12)13-8-6-10-4-3-9-16-10/h3-4,9,11,13H,1-2,5-8H2,(H,14,15)/p+1/t11-/m1/s1