[(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-3-phenyl-propyl]azanium

Systemtic Name: [(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-3-phenyl-propyl]azanium Openeye Name: [(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-3-phenyl-propyl]ammonium CAS Name: [(2S)-2-(4-ethyl-1-piperazin-4-iumyl)-3-phenylpropyl]ammonium IUPAC Name: [(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-3-phenylpropyl]azanium Traditional Name: [(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-3-phenyl-propyl]ammonium Formula: C15H27N3+2 MolecularWeight: 249.39498

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(CC2=CC=CC=C2)C[NH3+]

Isomeric SMILES

CC[NH+]1CCN(CC1)[C@@H](CC2=CC=CC=C2)C[NH3+]

InChI

InChI=1S/C15H25N3/c1-2-17-8-10-18(11-9-17)15(13-16)12-14-6-4-3-5-7-14/h3-7,15H,2,8-13,16H2,1H3/p+2/t15-/m0/s1