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

Systemtic Name: (3S)-N-methyl-N-[(4-methylphenyl)methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-methyl-N-(p-tolylmethyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-methyl-N-[(4-methylphenyl)methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-methyl-N-[(4-methylphenyl)methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-methyl-N-(4-methylbenzyl)piperidin-1-ium-3-carboxamide Formula: C15H23N2O+ MolecularWeight: 247.35592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O/c1-12-5-7-13(8-6-12)11-17(2)15(18)14-4-3-9-16-10-14/h5-8,14,16H,3-4,9-11H2,1-2H3/p+1/t14-/m0/s1