2-piperazin-4-ium-1-ylethyl-[[(1R,2S,6S)-2,4,6-trimethylcyclohex-3-en-1-yl]methyl]azanium

Systemtic Name: 2-piperazin-4-ium-1-ylethyl-[[(1R,2S,6S)-2,4,6-trimethylcyclohex-3-en-1-yl]methyl]azanium Openeye Name: 2-piperazin-4-ium-1-ylethyl-[[(1R,2S,6S)-2,4,6-trimethylcyclohex-3-en-1-yl]methyl]ammonium CAS Name: 2-(1-piperazin-4-iumyl)ethyl-[[(1R,2S,6S)-2,4,6-trimethyl-1-cyclohex-3-enyl]methyl]ammonium IUPAC Name: 2-piperazin-4-ium-1-ylethyl-[[(1R,2S,6S)-2,4,6-trimethylcyclohex-3-en-1-yl]methyl]azanium Traditional Name: 2-piperazin-4-ium-1-ylethyl-[[(1R,2S,6S)-2,4,6-trimethylcyclohex-3-en-1-yl]methyl]ammonium Formula: C16H33N3+2 MolecularWeight: 267.45332

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC(C1C[NH2+]CCN2CC[NH2+]CC2)C)C

Isomeric SMILES

C[C@H]1CC(=C[C@@H]([C@@H]1C[NH2+]CCN2CC[NH2+]CC2)C)C

InChI

InChI=1S/C16H31N3/c1-13-10-14(2)16(15(3)11-13)12-18-6-9-19-7-4-17-5-8-19/h10,14-18H,4-9,11-12H2,1-3H3/p+2/t14-,15-,16-/m0/s1