(2R,6R)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2,6-dimethyl-piperazin-4-ium

Systemtic Name: (2R,6R)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2,6-dimethyl-piperazin-4-ium Openeye Name: (2R,6R)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2,6-dimethyl-piperazin-4-ium CAS Name: (2R,6R)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2,6-dimethylpiperazin-4-ium IUPAC Name: (2R,6R)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2,6-dimethylpiperazin-4-ium Traditional Name: (2R,6R)-1-homoveratryl-2,6-dimethyl-piperazin-4-ium Formula: C16H27N2O2+ MolecularWeight: 279.39778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH2+]CC(N1CCC2=CC(=C(C=C2)OC)OC)C

Isomeric SMILES

C[C@@H]1C[NH2+]C[C@H](N1CCC2=CC(=C(C=C2)OC)OC)C

InChI

InChI=1S/C16H26N2O2/c1-12-10-17-11-13(2)18(12)8-7-14-5-6-15(19-3)16(9-14)20-4/h5-6,9,12-13,17H,7-8,10-11H2,1-4H3/p+1/t12-,13-/m1/s1