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

Systemtic Name: [(2S)-3-methylbutan-2-yl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Openeye Name: [(1S)-1,2-dimethylpropyl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium CAS Name: [(2S)-3-methylbutan-2-yl]-[2-methyl-2-(4-methyl-1-piperazin-4-iumyl)propyl]ammonium IUPAC Name: [(2S)-3-methylbutan-2-yl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Traditional Name: [(1S)-1,2-dimethylpropyl]-[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:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H31N3/c1-12(2)13(3)15-11-14(4,5)17-9-7-16(6)8-10-17/h12-13,15H,7-11H2,1-6H3/p+2/t13-/m0/s1