(1S)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-(2,4,6-trimethylphenyl)ethanamine

Systemtic Name: (1S)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-(2,4,6-trimethylphenyl)ethanamine Openeye Name: (1S)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-(2,4,6-trimethylphenyl)ethanamine CAS Name: (1S)-2-[(2S)-2-methyl-1-piperidin-1-iumyl]-1-(2,4,6-trimethylphenyl)ethanamine IUPAC Name: (1S)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-(2,4,6-trimethylphenyl)ethanamine Traditional Name: [(1S)-1-mesityl-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]amine Formula: C17H29N2+ MolecularWeight: 261.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC(C2=C(C=C(C=C2C)C)C)N

Isomeric SMILES

C[C@H]1CCCC[NH+]1C[C@H](C2=C(C=C(C=C2C)C)C)N

InChI

InChI=1S/C17H28N2/c1-12-9-13(2)17(14(3)10-12)16(18)11-19-8-6-5-7-15(19)4/h9-10,15-16H,5-8,11,18H2,1-4H3/p+1/t15-,16+/m0/s1