[(2S)-1-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propan-2-yl]azanium

Systemtic Name: [(2S)-1-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propan-2-yl]azanium Openeye Name: [(1S)-1-methyl-2-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]ethyl]ammonium CAS Name: [(2S)-1-[(2S)-4-methyl-2-phenyl-1-piperazin-4-iumyl]propan-2-yl]ammonium IUPAC Name: [(2S)-1-[(2S)-4-methyl-2-phenylpiperazin-4-ium-1-yl]propan-2-yl]azanium Traditional Name: [(1S)-1-methyl-2-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]ethyl]ammonium Formula: C14H25N3+2 MolecularWeight: 235.3684

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CC[NH+](CC1C2=CC=CC=C2)C)[NH3+]

Isomeric SMILES

C[C@@H](CN1CC[NH+](C[C@@H]1C2=CC=CC=C2)C)[NH3+]

InChI

InChI=1S/C14H23N3/c1-12(15)10-17-9-8-16(2)11-14(17)13-6-4-3-5-7-13/h3-7,12,14H,8-11,15H2,1-2H3/p+2/t12-,14+/m0/s1