[(2S,4R)-2-ethyl-4-methyl-2-(4-propylpiperazin-4-ium-1-yl)hexyl]azanium

Systemtic Name: [(2S,4R)-2-ethyl-4-methyl-2-(4-propylpiperazin-4-ium-1-yl)hexyl]azanium Openeye Name: [(2S,4R)-2-ethyl-4-methyl-2-(4-propylpiperazin-4-ium-1-yl)hexyl]ammonium CAS Name: [(2S,4R)-2-ethyl-4-methyl-2-(4-propyl-1-piperazin-4-iumyl)hexyl]ammonium IUPAC Name: [(2S,4R)-2-ethyl-4-methyl-2-(4-propylpiperazin-4-ium-1-yl)hexyl]azanium Traditional Name: [(2S,4R)-2-ethyl-4-methyl-2-(4-propylpiperazin-4-ium-1-yl)hexyl]ammonium Formula: C16H37N3+2 MolecularWeight: 271.48508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H35N3/c1-5-8-18-9-11-19(12-10-18)16(7-3,14-17)13-15(4)6-2/h15H,5-14,17H2,1-4H3/p+2/t15-,16+/m1/s1