[(2S)-2-(2,4-dimethylphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(2,4-dimethylphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]azanium Openeye Name: [(2S)-2-(2,4-dimethylphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]ammonium CAS Name: [(2S)-2-(2,4-dimethylphenyl)-2-(4-methyl-1-piperidin-1-iumyl)ethyl]ammonium IUPAC Name: [(2S)-2-(2,4-dimethylphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]azanium Traditional Name: [(2S)-2-(2,4-dimethylphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]ammonium Formula: C16H28N2+2 MolecularWeight: 248.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(C[NH3+])C2=C(C=C(C=C2)C)C

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](C[NH3+])C2=C(C=C(C=C2)C)C

InChI

InChI=1S/C16H26N2/c1-12-6-8-18(9-7-12)16(11-17)15-5-4-13(2)10-14(15)3/h4-5,10,12,16H,6-9,11,17H2,1-3H3/p+2/t16-/m1/s1