(3S)-N-(4-methylphenyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-(4-methylphenyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-(p-tolyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-(4-methylphenyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(4-methylphenyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-(p-tolyl)piperidin-1-ium-3-carboxamide Formula: C13H19N2O+ MolecularWeight: 219.30276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O/c1-10-4-6-12(7-5-10)15-13(16)11-3-2-8-14-9-11/h4-7,11,14H,2-3,8-9H2,1H3,(H,15,16)/p+1/t11-/m0/s1