4-[2-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]ethyl]aniline

Systemtic Name: 4-[2-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]ethyl]aniline Openeye Name: 4-[2-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]ethyl]aniline CAS Name: 4-[2-[(2S,6S)-2,6-dimethyl-1-piperidin-1-iumyl]ethyl]aniline IUPAC Name: 4-[2-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]ethyl]aniline Traditional Name: [4-[2-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]ethyl]phenyl]amine Formula: C15H25N2+ MolecularWeight: 233.3724

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1CCC2=CC=C(C=C2)N)C

Isomeric SMILES

C[C@H]1CCC[C@@H]([NH+]1CCC2=CC=C(C=C2)N)C

InChI

InChI=1S/C15H24N2/c1-12-4-3-5-13(2)17(12)11-10-14-6-8-15(16)9-7-14/h6-9,12-13H,3-5,10-11,16H2,1-2H3/p+1/t12-,13-/m0/s1