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

Systemtic Name: (3S)-N-(2,3-dimethylphenyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-(2,3-dimethylphenyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-(2,3-dimethylphenyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(2,3-dimethylphenyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-(2,3-dimethylphenyl)piperidin-1-ium-3-carboxamide Formula: C14H21N2O+ MolecularWeight: 233.32934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2CCC[NH2+]C2)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)[C@H]2CCC[NH2+]C2)C

InChI

InChI=1S/C14H20N2O/c1-10-5-3-7-13(11(10)2)16-14(17)12-6-4-8-15-9-12/h3,5,7,12,15H,4,6,8-9H2,1-2H3,(H,16,17)/p+1/t12-/m0/s1