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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2CCC[NH2+]C2)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)[C@H]2CCC[NH2+]C2)OC

InChI

InChI=1S/C14H20N2O3/c1-18-11-5-6-12(13(8-11)19-2)16-14(17)10-4-3-7-15-9-10/h5-6,8,10,15H,3-4,7,9H2,1-2H3,(H,16,17)/p+1/t10-/m0/s1