(2R)-2-[(2,5-dimethoxyphenyl)methyl]pyrrolidin-1-ium

Systemtic Name: (2R)-2-[(2,5-dimethoxyphenyl)methyl]pyrrolidin-1-ium Openeye Name: (2R)-2-[(2,5-dimethoxyphenyl)methyl]pyrrolidin-1-ium CAS Name: (2R)-2-[(2,5-dimethoxyphenyl)methyl]pyrrolidin-1-ium IUPAC Name: (2R)-2-[(2,5-dimethoxyphenyl)methyl]pyrrolidin-1-ium Traditional Name: (2R)-2-(2,5-dimethoxybenzyl)pyrrolidin-1-ium Formula: C13H20NO2+ MolecularWeight: 222.3034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CC2CCC[NH2+]2

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C[C@H]2CCC[NH2+]2

InChI

InChI=1S/C13H19NO2/c1-15-12-5-6-13(16-2)10(9-12)8-11-4-3-7-14-11/h5-6,9,11,14H,3-4,7-8H2,1-2H3/p+1/t11-/m1/s1