(2S)-2-(2,5-dimethoxyphenyl)piperidin-1-ium

Systemtic Name: (2S)-2-(2,5-dimethoxyphenyl)piperidin-1-ium Openeye Name: (2S)-2-(2,5-dimethoxyphenyl)piperidin-1-ium CAS Name: (2S)-2-(2,5-dimethoxyphenyl)piperidin-1-ium IUPAC Name: (2S)-2-(2,5-dimethoxyphenyl)piperidin-1-ium Traditional Name: (2S)-2-(2,5-dimethoxyphenyl)piperidin-1-ium Formula: C13H20NO2+ MolecularWeight: 222.3034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCC[NH2+]2

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO2/c1-15-10-6-7-13(16-2)11(9-10)12-5-3-4-8-14-12/h6-7,9,12,14H,3-5,8H2,1-2H3/p+1/t12-/m0/s1