2-(2-methylphenyl)-N-[(3S)-piperidin-1-ium-3-yl]ethanamide

Systemtic Name: 2-(2-methylphenyl)-N-[(3S)-piperidin-1-ium-3-yl]ethanamide Openeye Name: 2-(o-tolyl)-N-[(3S)-piperidin-1-ium-3-yl]acetamide CAS Name: 2-(2-methylphenyl)-N-[(3S)-3-piperidin-1-iumyl]acetamide IUPAC Name: 2-(2-methylphenyl)-N-[(3S)-piperidin-1-ium-3-yl]acetamide Traditional Name: 2-(o-tolyl)-N-[(3S)-piperidin-1-ium-3-yl]acetamide Formula: C14H21N2O+ MolecularWeight: 233.32934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC2CCC[NH2+]C2

Isomeric SMILES

CC1=CC=CC=C1CC(=O)N[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C14H20N2O/c1-11-5-2-3-6-12(11)9-14(17)16-13-7-4-8-15-10-13/h2-3,5-6,13,15H,4,7-10H2,1H3,(H,16,17)/p+1/t13-/m0/s1