[(1S)-1-[4-[2-oxidanylidene-2-(propylamino)ethoxy]phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[4-[2-oxidanylidene-2-(propylamino)ethoxy]phenyl]ethyl]azanium Openeye Name: [(1S)-1-[4-[2-oxo-2-(propylamino)ethoxy]phenyl]ethyl]ammonium CAS Name: [(1S)-1-[4-[2-oxo-2-(propylamino)ethoxy]phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[4-[2-oxo-2-(propylamino)ethoxy]phenyl]ethyl]azanium Traditional Name: [(1S)-1-[4-[2-keto-2-(propylamino)ethoxy]phenyl]ethyl]ammonium Formula: C13H21N2O2+ MolecularWeight: 237.31804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC1=CC=C(C=C1)C(C)[NH3+]

Isomeric SMILES

CCCNC(=O)COC1=CC=C(C=C1)[C@H](C)[NH3+]

InChI

InChI=1S/C13H20N2O2/c1-3-8-15-13(16)9-17-12-6-4-11(5-7-12)10(2)14/h4-7,10H,3,8-9,14H2,1-2H3,(H,15,16)/p+1/t10-/m0/s1