(3S)-3-[(2-methylphenyl)methoxymethyl]piperidin-1-ium

Systemtic Name: (3S)-3-[(2-methylphenyl)methoxymethyl]piperidin-1-ium Openeye Name: (3S)-3-(o-tolylmethoxymethyl)piperidin-1-ium CAS Name: (3S)-3-[(2-methylphenyl)methoxymethyl]piperidin-1-ium IUPAC Name: (3S)-3-[(2-methylphenyl)methoxymethyl]piperidin-1-ium Traditional Name: (3S)-3-[(2-methylbenzyl)oxymethyl]piperidin-1-ium Formula: C14H22NO+ MolecularWeight: 220.33058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COCC2CCC[NH2+]C2

Isomeric SMILES

CC1=CC=CC=C1COC[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C14H21NO/c1-12-5-2-3-7-14(12)11-16-10-13-6-4-8-15-9-13/h2-3,5,7,13,15H,4,6,8-11H2,1H3/p+1/t13-/m0/s1