[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]-[(2S,3S)-3-methylpentan-2-yl]azanium

Systemtic Name: [2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]-[(2S,3S)-3-methylpentan-2-yl]azanium Openeye Name: [(1S,2S)-1,2-dimethylbutyl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium CAS Name: [2-methyl-2-(4-methyl-1-piperazin-4-iumyl)propyl]-[(2S,3S)-3-methylpentan-2-yl]ammonium IUPAC Name: [2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]-[(2S,3S)-3-methylpentan-2-yl]azanium Traditional Name: [(1S,2S)-1,2-dimethylbutyl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium Formula: C15H35N3+2 MolecularWeight: 257.4585

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)[NH2+]CC(C)(C)N1CC[NH+](CC1)C

Isomeric SMILES

CC[C@H](C)[C@H](C)[NH2+]CC(C)(C)N1CC[NH+](CC1)C

InChI

InChI=1S/C15H33N3/c1-7-13(2)14(3)16-12-15(4,5)18-10-8-17(6)9-11-18/h13-14,16H,7-12H2,1-6H3/p+2/t13-,14-/m0/s1