5-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-2-methyl-aniline

Systemtic Name: 5-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-2-methyl-aniline Openeye Name: 5-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-2-methyl-aniline CAS Name: 5-[[(2S,6S)-2,6-dimethyl-1-piperidin-1-iumyl]methyl]-2-methylaniline IUPAC Name: 5-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-2-methylaniline Traditional Name: [5-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-2-methyl-phenyl]amine Formula: C15H25N2+ MolecularWeight: 233.3724

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1CC2=CC(=C(C=C2)C)N)C

Isomeric SMILES

C[C@H]1CCC[C@@H]([NH+]1CC2=CC(=C(C=C2)C)N)C

InChI

InChI=1S/C15H24N2/c1-11-7-8-14(9-15(11)16)10-17-12(2)5-4-6-13(17)3/h7-9,12-13H,4-6,10,16H2,1-3H3/p+1/t12-,13-/m0/s1