[(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(2,4,6-trimethylphenyl)ethyl]azanium

Systemtic Name: [(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(2,4,6-trimethylphenyl)ethyl]azanium Openeye Name: [(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(2,4,6-trimethylphenyl)ethyl]ammonium CAS Name: [(2S)-2-(4-ethyl-1-piperazin-4-iumyl)-2-(2,4,6-trimethylphenyl)ethyl]ammonium IUPAC Name: [(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(2,4,6-trimethylphenyl)ethyl]azanium Traditional Name: [(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-mesityl-ethyl]ammonium Formula: C17H31N3+2 MolecularWeight: 277.44814

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(C[NH3+])C2=C(C=C(C=C2C)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)[C@H](C[NH3+])C2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C17H29N3/c1-5-19-6-8-20(9-7-19)16(12-18)17-14(3)10-13(2)11-15(17)4/h10-11,16H,5-9,12,18H2,1-4H3/p+2/t16-/m1/s1