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

Systemtic Name: 4-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]butylazanium Openeye Name: 4-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]butylammonium CAS Name: 4-[(2S)-4-methyl-2-phenyl-1-piperazine-1,4-diiumyl]butylammonium IUPAC Name: 4-[(2S)-4-methyl-2-phenylpiperazine-1,4-diium-1-yl]butylazanium Traditional Name: 4-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]butylammonium Formula: C15H28N3+3 MolecularWeight: 250.40292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N3/c1-17-11-12-18(10-6-5-9-16)15(13-17)14-7-3-2-4-8-14/h2-4,7-8,15H,5-6,9-13,16H2,1H3/p+3/t15-/m1/s1