[(2S)-2-(4-methylpiperazin-4-ium-1-yl)-4-phenyl-butyl]azanium

Systemtic Name: [(2S)-2-(4-methylpiperazin-4-ium-1-yl)-4-phenyl-butyl]azanium Openeye Name: [(2S)-2-(4-methylpiperazin-4-ium-1-yl)-4-phenyl-butyl]ammonium CAS Name: [(2S)-2-(4-methyl-1-piperazin-4-iumyl)-4-phenylbutyl]ammonium IUPAC Name: [(2S)-2-(4-methylpiperazin-4-ium-1-yl)-4-phenylbutyl]azanium Traditional Name: [(2S)-2-(4-methylpiperazin-4-ium-1-yl)-4-phenyl-butyl]ammonium Formula: C15H27N3+2 MolecularWeight: 249.39498

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(CCC2=CC=CC=C2)C[NH3+]

Isomeric SMILES

C[NH+]1CCN(CC1)[C@@H](CCC2=CC=CC=C2)C[NH3+]

InChI

InChI=1S/C15H25N3/c1-17-9-11-18(12-10-17)15(13-16)8-7-14-5-3-2-4-6-14/h2-6,15H,7-13,16H2,1H3/p+2/t15-/m0/s1