(3R,5R)-1-[6-(2,6-dimethoxyphenoxy)hexyl]-3,5-dimethyl-piperidin-1-ium

Systemtic Name: (3R,5R)-1-[6-(2,6-dimethoxyphenoxy)hexyl]-3,5-dimethyl-piperidin-1-ium Openeye Name: (3R,5R)-1-[6-(2,6-dimethoxyphenoxy)hexyl]-3,5-dimethyl-piperidin-1-ium CAS Name: (3R,5R)-1-[6-(2,6-dimethoxyphenoxy)hexyl]-3,5-dimethylpiperidin-1-ium IUPAC Name: (3R,5R)-1-[6-(2,6-dimethoxyphenoxy)hexyl]-3,5-dimethylpiperidin-1-ium Traditional Name: (3R,5R)-1-[6-(2,6-dimethoxyphenoxy)hexyl]-3,5-dimethyl-piperidin-1-ium Formula: C21H36NO3+ MolecularWeight: 350.51544

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCCCCCOC2=C(C=CC=C2OC)OC)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CCCCCCOC2=C(C=CC=C2OC)OC)C

InChI

InChI=1S/C21H35NO3/c1-17-14-18(2)16-22(15-17)12-7-5-6-8-13-25-21-19(23-3)10-9-11-20(21)24-4/h9-11,17-18H,5-8,12-16H2,1-4H3/p+1/t17-,18-/m1/s1