6-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]hexylazanium

Systemtic Name: 6-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]hexylazanium Openeye Name: 6-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]hexylammonium CAS Name: 6-[(2S)-4-methyl-2-phenyl-1-piperazine-1,4-diiumyl]hexylammonium IUPAC Name: 6-[(2S)-4-methyl-2-phenylpiperazine-1,4-diium-1-yl]hexylazanium Traditional Name: 6-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]hexylammonium Formula: C17H32N3+3 MolecularWeight: 278.45608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29N3/c1-19-13-14-20(12-8-3-2-7-11-18)17(15-19)16-9-5-4-6-10-16/h4-6,9-10,17H,2-3,7-8,11-15,18H2,1H3/p+3/t17-/m1/s1