1-[(1S)-1-(3-methoxyphenyl)ethyl]piperazin-4-ium

Systemtic Name: 1-[(1S)-1-(3-methoxyphenyl)ethyl]piperazin-4-ium Openeye Name: 1-[(1S)-1-(3-methoxyphenyl)ethyl]piperazin-4-ium CAS Name: 1-[(1S)-1-(3-methoxyphenyl)ethyl]piperazin-4-ium IUPAC Name: 1-[(1S)-1-(3-methoxyphenyl)ethyl]piperazin-4-ium Traditional Name: 1-[(1S)-1-(3-methoxyphenyl)ethyl]piperazin-4-ium Formula: C13H21N2O+ MolecularWeight: 221.31864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)OC)N2CC[NH2+]CC2

Isomeric SMILES

C[C@@H](C1=CC(=CC=C1)OC)N2CC[NH2+]CC2

InChI

InChI=1S/C13H20N2O/c1-11(15-8-6-14-7-9-15)12-4-3-5-13(10-12)16-2/h3-5,10-11,14H,6-9H2,1-2H3/p+1/t11-/m0/s1