(2R)-N-(3,4-dimethoxyphenyl)piperidin-1-ium-2-carboxamide

Systemtic Name: (2R)-N-(3,4-dimethoxyphenyl)piperidin-1-ium-2-carboxamide Openeye Name: (2R)-N-(3,4-dimethoxyphenyl)piperidin-1-ium-2-carboxamide CAS Name: (2R)-N-(3,4-dimethoxyphenyl)-2-piperidin-1-iumcarboxamide IUPAC Name: (2R)-N-(3,4-dimethoxyphenyl)piperidin-1-ium-2-carboxamide Traditional Name: (2R)-N-(3,4-dimethoxyphenyl)piperidin-1-ium-2-carboxamide Formula: C14H21N2O3+ MolecularWeight: 265.32814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O3/c1-18-12-7-6-10(9-13(12)19-2)16-14(17)11-5-3-4-8-15-11/h6-7,9,11,15H,3-5,8H2,1-2H3,(H,16,17)/p+1/t11-/m1/s1