[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]-[(2S)-pentan-2-yl]azanium

Systemtic Name: [2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]-[(2S)-pentan-2-yl]azanium Openeye Name: [(1S)-1-methylbutyl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium CAS Name: [2-methyl-2-(4-methyl-1-piperazin-4-iumyl)propyl]-[(2S)-pentan-2-yl]ammonium IUPAC Name: [2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]-[(2S)-pentan-2-yl]azanium Traditional Name: [(1S)-1-methylbutyl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium Formula: C14H33N3+2 MolecularWeight: 243.43192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H31N3/c1-6-7-13(2)15-12-14(3,4)17-10-8-16(5)9-11-17/h13,15H,6-12H2,1-5H3/p+2/t13-/m0/s1