3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propylazanium

Systemtic Name: 3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propylazanium Openeye Name: 3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propylammonium CAS Name: 3-[(2S)-4-methyl-2-phenyl-1-piperazin-4-iumyl]propylammonium IUPAC Name: 3-[(2S)-4-methyl-2-phenylpiperazin-4-ium-1-yl]propylazanium Traditional Name: 3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propylammonium Formula: C14H25N3+2 MolecularWeight: 235.3684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23N3/c1-16-10-11-17(9-5-8-15)14(12-16)13-6-3-2-4-7-13/h2-4,6-7,14H,5,8-12,15H2,1H3/p+2/t14-/m1/s1