(1S)-1-(3,4-dimethylphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamine

Systemtic Name: (1S)-1-(3,4-dimethylphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamine Openeye Name: (1S)-1-(3,4-dimethylphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamine CAS Name: (1S)-1-(3,4-dimethylphenyl)-2-[(2S)-2-methyl-1-piperidin-1-iumyl]ethanamine IUPAC Name: (1S)-1-(3,4-dimethylphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamine Traditional Name: [(1S)-1-(3,4-dimethylphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]amine Formula: C16H27N2+ MolecularWeight: 247.39898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2/c1-12-7-8-15(10-13(12)2)16(17)11-18-9-5-4-6-14(18)3/h7-8,10,14,16H,4-6,9,11,17H2,1-3H3/p+1/t14-,16+/m0/s1