[(2R,3R)-3-methyl-1-(4-propylpiperazin-4-ium-1-yl)pentan-2-yl]azanium

Systemtic Name: [(2R,3R)-3-methyl-1-(4-propylpiperazin-4-ium-1-yl)pentan-2-yl]azanium Openeye Name: [(1R,2R)-2-methyl-1-[(4-propylpiperazin-4-ium-1-yl)methyl]butyl]ammonium CAS Name: [(2R,3R)-3-methyl-1-(4-propyl-1-piperazin-4-iumyl)pentan-2-yl]ammonium IUPAC Name: [(2R,3R)-3-methyl-1-(4-propylpiperazin-4-ium-1-yl)pentan-2-yl]azanium Traditional Name: [(1R,2R)-2-methyl-1-[(4-propylpiperazin-4-ium-1-yl)methyl]butyl]ammonium Formula: C13H31N3+2 MolecularWeight: 229.40534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H29N3/c1-4-6-15-7-9-16(10-8-15)11-13(14)12(3)5-2/h12-13H,4-11,14H2,1-3H3/p+2/t12-,13+/m1/s1