[(2S)-3-methyl-2-(4-propylpiperazin-4-ium-1-yl)butyl]azanium

Systemtic Name: [(2S)-3-methyl-2-(4-propylpiperazin-4-ium-1-yl)butyl]azanium Openeye Name: [(2S)-3-methyl-2-(4-propylpiperazin-4-ium-1-yl)butyl]ammonium CAS Name: [(2S)-3-methyl-2-(4-propyl-1-piperazin-4-iumyl)butyl]ammonium IUPAC Name: [(2S)-3-methyl-2-(4-propylpiperazin-4-ium-1-yl)butyl]azanium Traditional Name: [(2S)-3-methyl-2-(4-propylpiperazin-4-ium-1-yl)butyl]ammonium Formula: C12H29N3+2 MolecularWeight: 215.37876

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(C[NH3+])C(C)C

Isomeric SMILES

CCC[NH+]1CCN(CC1)[C@H](C[NH3+])C(C)C

InChI

InChI=1S/C12H27N3/c1-4-5-14-6-8-15(9-7-14)12(10-13)11(2)3/h11-12H,4-10,13H2,1-3H3/p+2/t12-/m1/s1