(2-methoxy-2-oxidanylidene-ethyl)-[(1S)-1-phenylbutyl]azanium

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl)-[(1S)-1-phenylbutyl]azanium Openeye Name: (2-methoxy-2-oxo-ethyl)-[(1S)-1-phenylbutyl]ammonium CAS Name: (2-methoxy-2-oxoethyl)-[(1S)-1-phenylbutyl]ammonium IUPAC Name: (2-methoxy-2-oxoethyl)-[(1S)-1-phenylbutyl]azanium Traditional Name: (2-keto-2-methoxy-ethyl)-[(1S)-1-phenylbutyl]ammonium Formula: C13H20NO2+ MolecularWeight: 222.3034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)[NH2+]CC(=O)OC

Isomeric SMILES

CCC[C@@H](C1=CC=CC=C1)[NH2+]CC(=O)OC

InChI

InChI=1S/C13H19NO2/c1-3-7-12(14-10-13(15)16-2)11-8-5-4-6-9-11/h4-6,8-9,12,14H,3,7,10H2,1-2H3/p+1/t12-/m0/s1