[1-[[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]methyl]cyclohexyl]azanium

Systemtic Name: [1-[[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]methyl]cyclohexyl]azanium Openeye Name: [1-[[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]methyl]cyclohexyl]ammonium CAS Name: [1-[[(2S)-4-methyl-2-phenyl-1-piperazine-1,4-diiumyl]methyl]cyclohexyl]ammonium IUPAC Name: [1-[[(2S)-4-methyl-2-phenylpiperazine-1,4-diium-1-yl]methyl]cyclohexyl]azanium Traditional Name: [1-[[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]methyl]cyclohexyl]ammonium Formula: C18H32N3+3 MolecularWeight: 290.46678

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](C(C1)C2=CC=CC=C2)CC3(CCCCC3)[NH3+]

Isomeric SMILES

C[NH+]1CC[NH+]([C@H](C1)C2=CC=CC=C2)CC3(CCCCC3)[NH3+]

InChI

InChI=1S/C18H29N3/c1-20-12-13-21(15-18(19)10-6-3-7-11-18)17(14-20)16-8-4-2-5-9-16/h2,4-5,8-9,17H,3,6-7,10-15,19H2,1H3/p+3/t17-/m1/s1