2-[4-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]piperazin-4-ium-1-yl]pyrimidine

Systemtic Name: 2-[4-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]piperazin-4-ium-1-yl]pyrimidine Openeye Name: 2-[4-[(1R)-2-(3,4-dimethoxyphenyl)-1-methyl-ethyl]piperazin-4-ium-1-yl]pyrimidine CAS Name: 2-[4-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-1-piperazin-4-iumyl]pyrimidine IUPAC Name: 2-[4-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]piperazin-4-ium-1-yl]pyrimidine Traditional Name: 2-[4-[(1R)-2-(3,4-dimethoxyphenyl)-1-methyl-ethyl]piperazin-4-ium-1-yl]pyrimidine Formula: C19H27N4O2+ MolecularWeight: 343.44328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C=C1)OC)OC)[NH+]2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

C[C@H](CC1=CC(=C(C=C1)OC)OC)[NH+]2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C19H26N4O2/c1-15(13-16-5-6-17(24-2)18(14-16)25-3)22-9-11-23(12-10-22)19-20-7-4-8-21-19/h4-8,14-15H,9-13H2,1-3H3/p+1/t15-/m1/s1