[(2S)-1-[(3-methylphenyl)methyl]piperidin-1-ium-2-yl]methylazanium

Systemtic Name: [(2S)-1-[(3-methylphenyl)methyl]piperidin-1-ium-2-yl]methylazanium Openeye Name: [(2S)-1-(m-tolylmethyl)piperidin-1-ium-2-yl]methylammonium CAS Name: [(2S)-1-[(3-methylphenyl)methyl]-2-piperidin-1-iumyl]methylammonium IUPAC Name: [(2S)-1-[(3-methylphenyl)methyl]piperidin-1-ium-2-yl]methylazanium Traditional Name: [(2S)-1-(3-methylbenzyl)piperidin-1-ium-2-yl]methylammonium Formula: C14H24N2+2 MolecularWeight: 220.35376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCCCC2C[NH3+]

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCCC[C@H]2C[NH3+]

InChI

InChI=1S/C14H22N2/c1-12-5-4-6-13(9-12)11-16-8-3-2-7-14(16)10-15/h4-6,9,14H,2-3,7-8,10-11,15H2,1H3/p+2/t14-/m0/s1