5-[[4-[(3R)-1-(2,2-dimethylpropyl)pyrrolidin-1-ium-3-yl]piperidin-1-ium-1-yl]methyl]-2-methoxy-pyrimidine

Systemtic Name: 5-[[4-[(3R)-1-(2,2-dimethylpropyl)pyrrolidin-1-ium-3-yl]piperidin-1-ium-1-yl]methyl]-2-methoxy-pyrimidine Openeye Name: 5-[[4-[(3R)-1-(2,2-dimethylpropyl)pyrrolidin-1-ium-3-yl]piperidin-1-ium-1-yl]methyl]-2-methoxy-pyrimidine CAS Name: 5-[[4-[(3R)-1-(2,2-dimethylpropyl)-3-pyrrolidin-1-iumyl]-1-piperidin-1-iumyl]methyl]-2-methoxypyrimidine IUPAC Name: 5-[[4-[(3R)-1-(2,2-dimethylpropyl)pyrrolidin-1-ium-3-yl]piperidin-1-ium-1-yl]methyl]-2-methoxypyrimidine Traditional Name: 2-methoxy-5-[[4-[(3R)-1-neopentylpyrrolidin-1-ium-3-yl]piperidin-1-ium-1-yl]methyl]pyrimidine Formula: C20H36N4O+2 MolecularWeight: 348.52604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C[NH+]1CCC(C1)C2CC[NH+](CC2)CC3=CN=C(N=C3)OC

Isomeric SMILES

CC(C)(C)C[NH+]1CC[C@@H](C1)C2CC[NH+](CC2)CC3=CN=C(N=C3)OC

InChI

InChI=1S/C20H34N4O/c1-20(2,3)15-24-10-7-18(14-24)17-5-8-23(9-6-17)13-16-11-21-19(25-4)22-12-16/h11-12,17-18H,5-10,13-15H2,1-4H3/p+2/t18-/m0/s1